On melting dynamics and the glass transition. II. Glassy dynamics as a melting process.
Krzakala, Florent; Zdeborová, Lenka
2011-01-21
There are deep analogies between the melting dynamics in systems with a first-order phase transition and the dynamics from equilibrium in super-cooled liquids. For a class of Ising spin models undergoing a first-order transition--namely p-spin models on the so-called Nishimori line--it can be shown that the melting dynamics can be exactly mapped to the equilibrium dynamics. In this mapping the dynamical--or mode-coupling--glass transition corresponds to the spinodal point, while the Kauzmann transition corresponds to the first-order phase transition itself. Both in mean field and finite dimensional models this mapping provides an exact realization of the random first-order theory scenario for the glass transition. The corresponding glassy phenomenology can then be understood in the framework of a standard first-order phase transition.
Transition in the fractal geometry of Arctic melt ponds
Directory of Open Access Journals (Sweden)
C. Hohenegger
2012-10-01
Full Text Available During the Arctic melt season, the sea ice surface undergoes a remarkable transformation from vast expanses of snow covered ice to complex mosaics of ice and melt ponds. Sea ice albedo, a key parameter in climate modeling, is determined by the complex evolution of melt pond configurations. In fact, ice–albedo feedback has played a major role in the recent declines of the summer Arctic sea ice pack. However, understanding melt pond evolution remains a significant challenge to improving climate projections. By analyzing area–perimeter data from hundreds of thousands of melt ponds, we find here an unexpected separation of scales, where pond fractal dimension D transitions from 1 to 2 around a critical length scale of 100 m^{2} in area. Pond complexity increases rapidly through the transition as smaller ponds coalesce to form large connected regions, and reaches a maximum for ponds larger than 1000 m^{2}, whose boundaries resemble space-filling curves, with D ≈ 2. These universal features of Arctic melt pond evolution are similar to phase transitions in statistical physics. The results impact sea ice albedo, the transmitted radiation fields under melting sea ice, the heat balance of sea ice and the upper ocean, and biological productivity such as under ice phytoplankton blooms.
Effect of disorder on the melting phase transition
International Nuclear Information System (INIS)
Storey, M.
1999-01-01
This Ph.D thesis is concerned with the effect of disorder on the melting phase transition. In the first part, the research is focused on the melting of the flux lines in high temperature superconductors. An analytical approach to studying the effect of quenched disorder on the vortices is proposed. The main steps in proposed approach are drawn from classical thermodynamics. The principal step is to relate a superconductor in the flux line lattice state to a closed system in which two phases are in contact, solid and liquid, with the aim of determining what effect the pinning centres have on the melting temperature. That is to determine whether the melting temperature is raised or lowered with respect to that of the clean non-pinned superconductor. Flux lines are modelled by an elastic Hamiltonian and the quenched disorder by the Larkin pinning Hamiltonian. This analyses is performed for two-dimensional systems as well as three-dimensional ones. The second part of this thesis is concerned with a simulation approach to analysing the melting transition in two-dimension. Joint Molecular Dynamics-Monte Carlo simulations are performed to study the melting transition in two dimensions. Firstly, classical point particles interacting via a r -12 repulsive pair potential are investigated and secondly, disorder is added to this system by introducing randomly positioned attractive pins. In both cases the simulation method chosen is based on the bicanonical ensemble in conjunction with constant temperature molecular dynamics as introduced by H.C. Andersen. Bond orientational order, transitional order, pressure, and the specific heat as well as the potential energy of the system are determined. Histograms of these quantities are obtained throughout the transition region and used together with finite size scaling analysis to deduce t lie nature of the transition by, means of the Lee-Kosterlitz method. For the clean system the r -12 potential is first studied and is chosen for its
Observation of a prewetting transition during surface melting of caprolactam
Chandavarkar, Sumant; Geertman, Rob M.; de Jeu, Wim H.
1992-10-01
The surface-induced melting of the closed-packed (100) face of the anisotropic molecular crystal caprolactam has been studied using x-ray reflectivity. A thin-to-thick film prewetting transition is observed at about 13 K below the bulk melting point. Only above this transition does the thickness of the quasiliquid layer increase continuously with temperature. We speculate that initially the surface melting proceeds via layering transitions.
Berezinskii–Kosterlitz–Thouless transition and two-dimensional melting
Ryzhov, V. N.; Tareyeva, E. E.; Fomin, Yu D.; Tsiok, E. N.
2017-12-01
The main aspects of the theory of phase transitions in two-dimensional degenerate systems (Berezinskii–Kosterlitz–Thouless, or BKT, transitions) are reviewed in detail, including the transition mechanism, the renormalization group as a tool for describing the transition, and how the transition scenario can possibly depend on the core energy of topological defects (in particular, in thin superconducting films). Various melting scenarios in two-dimensional systems are analyzed, and the current status of actual experiments and computer simulations in the field is examined. Whereas in three dimensions melting always occurs as a single first-order transition, in two dimensions, as shown by Halperin, Nelson, and Young, melting via two continuous BKT transitions with an intermediate hexatic phase characterized by quasi-long-range orientational order is possible. But there is also a possibility for a first-order phase transition to occur. Recently, one further melting scenario, different from that occurring in the Berezinskii–Kosterlitz–Thouless–Halperin–Nelson–Young theory, has been proposed, according to which a solid can melt in two stages: a continuous BKT-type solid–hexatic transition and then a first-order hexatic-phase–isotropic-liquid phase transition. Particular attention is given to the melting scenario as a function of the potential shape and to the random pinning effect on two-dimensional melting. In particular, it is shown that random pinning can alter the melting scenario fundamentally in the case of a first-order transition. Also considered is the melting of systems with potentials having a negative curvature in the repulsion region–potentials that are successfully used in describing the anomalous properties of water in two dimensions. This review is an extended version of the report “Old and new in the physics of phase transitions” presented at the scientific session of the Physical Sciences Division of the Russian Academy of
Simulation of melt spreading in consideration of phase transitions
International Nuclear Information System (INIS)
Spengler, C.
2002-01-01
The analysis of melt spreading and relocation phenomena in the containment of LWR power plants in case of hypothetical severe accidents leading to core melting is an important issue for reactor safety investigations. For the simulation of melt spreading the code LAVA has been developed on the basis of a method from the related subject of volcanology by adding more detailed models for heat transfer phenomena and flow rheology. The development is supported by basic analysis of the spreading of gravity currents as well as experimental investigations of the rheology of solidifying melts. These exhibit strong non-Newtonian effects in case of a high content of solids in the freezing melt. The basic model assumption in LAVA is the ideal Bingham plastic approach to the non-Newtonian, shear-thinning characteristic of solidifying melts. For the recalculation of melt spreading experiments, the temperature-dependent material properties for solidifying melt mixtures have been calculated using correlations from the literature. With the parameters and correlations for the rheological material properties approached by results from literature, it was possible to recalculate successfully recent spreading experiments with simulant materials and prototypic reactor core materials. An application to the behaviour of core melt in the reactor cavity assumed a borderline case for the issue of spreading. This limit is represented by melt conditions (large solid fraction, low volume flux), under which the melt is hardly spreadable. Due to the persistent volume flux the reactor cavity is completely, but inhomogeneously filled with melt. The degree of inhomogeneity is rather small, so it is concluded, that for the long-term coolability of a melt pool in narrow cavities the spreading of melt will probably have only negligible influence. (orig.)
Viscosity model for aluminosilicate melt
Directory of Open Access Journals (Sweden)
Zhang G.H.
2012-01-01
Full Text Available The structurally based viscosity model proposed in our previous study is extended to include more components, e.g. SiO2, Al2O3, FeO, MnO, MgO, CaO, Na2O and K2O. A simple method is proposed to calculate the numbers of different types of oxygen ions classified by the different cations they bonded with, which is used to characterize the influence of composition on viscosity. When dealing with the aluminosilicate melts containing several basic oxides, the priority order is established for different cations for charge compensating Al3+ ions, according to the coulombic force between cation and oxygen anion. It is indicated that basic oxides have two paradox influences on viscosity: basic oxide with a higher basicity decreases viscosity more greatly by forming weaker non-bridging oxygen bond; while it increases viscosity more greatly by forming stronger bridging oxygen bond in tetrahedron after charge compensating Al3+ ion. The present model can extrapolate its application range to the system without SiO2. Furthermore, it could also give a satisfy interpretation to the abnormal phenomenon that viscosity increases when adding K2O to CaO-Al2O3-SiO2 melt within a certain composition range.
Multiscale Models of Melting Arctic Sea Ice
2014-09-30
Sea ice reflectance or albedo , a key parameter in climate modeling, is primarily determined by melt pond and ice floe configurations. Ice - albedo ...determine their albedo - a key parameter in climate modeling. Here we explore the possibility of a conceptual sea ice climate model passing through a...bifurcation points. Ising model for melt ponds on Arctic sea ice Y. Ma, I. Sudakov, and K. M. Golden Abstract: The albedo of melting
Melting and glass transition of radiation-induced graft polyethylene
International Nuclear Information System (INIS)
Toi, K.; Kikuchi, M.; Tokuda, T.
1977-01-01
Melting and glass transition data are reported employing DSC for styrene-grafted high-density polyethylene obtained by γ radiation. Judging from the data of the melting point and the heat of fusion, the grafted polystyrene had no effect on the polyethylene crystallites, but the half-width of the thermogram was observed to increase slightly, showing an effect on the crystallite size distribution. As no effect was observed on the glass transition temperature by grafting, the amorphous region of the polyethylene apparently was not affected. It is suggested, therefore, that the free volume or segmental mobility will not be decreased by radiation-induced grafting. Very few but long grafted chains had negligible effect on the average polyethylene chain length available for segmental motion, and grafted polystyrene should be expected to differ from the styrene homopolymer in thermal motions
Grove, Timothy L.; Holbig, Eva S.; Barr, Jay A.; Till, Christy B.; Krawczynski, Michael J.
2013-01-01
Phase equilibrium experiments on a compositionally modified olivine leucitite from the Tibetan plateau have been carried out from 2.2 to 2.8 GPa and 1,380–1,480 °C. The experiments-produced liquids multiply saturated with spinel and garnet lherzolite phase assemblages (olivine, orthopyroxene, clinopyroxene and spinel ± garnet) under nominally anhydrous conditions. These SiO2-undersaturated liquids and published experimental data are utilized to develop a predictive model for garnet lherzolite melting of compositionally variable mantle under anhydrous conditions over the pressure range of 1.9–6 GPa. The model estimates the major element compositions of garnet-saturated melts for a range of mantle lherzolite compositions and predicts the conditions of the spinel to garnet lherzolite phase transition for natural peridotite compositions at above-solidus temperatures and pressures. We compare our predicted garnet lherzolite melts to those of pyroxenite and carbonated lherzolite and develop criteria for distinguishing among melts of these different source types. We also use the model in conjunction with a published predictive model for plagioclase and spinel lherzolite to characterize the differences in major element composition for melts in the plagioclase, spinel and garnet facies and develop tests to distinguish between melts of these three lherzolite facies based on major elements. The model is applied to understand the source materials and conditions of melting for high-K lavas erupted in the Tibetan plateau, basanite–nephelinite lavas erupted early in the evolution of Kilauea volcano, Hawaii, as well as younger tholeiitic to alkali lavas from Kilauea.
Káldos, Réka; Guzmics, Tibor; Mitchell, Roger H.; Dawson, John Barry; Milke, Ralf; Szabó, Csaba
2015-12-01
This study presents compositional data for a statistically significant number (n = 180) of heated and quenched (recreated) carbonate melt inclusions trapped in magnetite and clinopyroxene in jacupirangite from Kerimasi volcano (Tanzania). On the basis of homogenization experiments for clinopyroxene-hosted melt inclusions and forsterite-monticellite-calcite phase relations, a range of 1000 to 900 °C is estimated for their crystallization temperatures. Petrographic observations and geochemical data show that during jacupirangite crystallization, a CaO-rich and alkali-"poor" carbonate melt (relative to Oldoinyo Lengai natrocarbonatite) existed and was entrapped in the precipitating magnetite, forming primary melt inclusions, and was also enclosed in previously crystallized clinopyroxene as secondary melt inclusions. The composition of the trapped carbonate melts in magnetite and clinopyroxene is very similar to the parental melt of Kerimasi calciocarbonatite; i.e., enriched in Na2O, K2O, F, Cl and S, but depleted in SiO2 and P2O5 relative to carbonate melts entrapped at an earlier stage and higher temperature (1050-1100 °C) during the formation of Kerimasi afrikandite. Significant compositional variation is shown by the major minerals of Kerimasi plutonic rocks (afrikandite, jacupirangite and calciocarbonatite). Magnetite and clinopyroxene in the jacupirangite are typically transitional in composition between those of afrikandite and calciocarbonatite. These data suggest that the jacupirangite represents an intermediate stage between the formation of afrikandite and calciocarbonatite. Jacupirangite most probably formed when immiscible silicate and carbonate melts separated from the afrikandite body, although the carbonate melt was not separated completely from the silicate melt fraction. In general, during the evolution of the carbonate melt at Kerimasi, concentrations of P2O5 and SiO2 decreased, whereas volatile content (alkalis, S, F, Cl and H2O) increased
International Nuclear Information System (INIS)
Ko, Junghyuk; Mohtaram, Nima Khadem; Willerth, Stephanie M; Jun, Martin B G; Lee, Patrick C
2015-01-01
Melt electrospinning can be used to fabricate various fibrous biomaterial scaffolds with a range of mechanical properties and varying topographical properties for different applications such as tissue scaffold and filtration and etc, making it a powerful technique. Engineering the topography of such electrospun microfibers can be easily done by tuning the operational parameters of this process. Recent experimental studies have shown promising results for fabricating various topographies, but there is no body of work that focuses on using mathematical models of this technique to further understand the effect of operational parameters on these properties of microfiber scaffolds. In this study, we developed a novel mathematical model using numerical simulations to demonstrate the effect of temperature, feed rate and flow rate on controlling topographical properties such as fiber diameter of these spun fibrous scaffolds. These promising modelling results are also compared to our previous and current experimental results. Overall, we show that our novel mathematical model can predict the topographical properties affected by key operational parameters such as change in temperature, flow rate and feed rate, and this model could serve as a promising strategy for the controlling of topographical properties of such structures for different applications. (paper)
Colloidal glass transition in unentangled polymer nanocomposite melts
International Nuclear Information System (INIS)
Anderson, Benjamin J; Zukoski, Charles F
2009-01-01
The linear and non-linear rheology of a high volume fraction particle filled unentangled polymer melt is measured. The particles in the polymer melt behave like hard spheres as the particle volume fraction is raised. At high volume fractions, the suspension develops a plateau elastic modulus. Over the frequency range of the elastic modulus plateau, the viscous modulus develops a minimum and a maximum. The frequencies of the two local extrema initially have critical power law scaling, suggesting the approach of a singular glass transition. At higher volume fractions in excess of the glass transition, the viscous modulus continues to show a well defined minimum and a well defined maximum. The non-linear moduli show a single perturbative yield point beyond which the suspension softens. The yielding behavior of the nanocomposite is shown to be sensitive to the strain frequency and the proximity of the strain frequency to the maximum frequency for the linear viscous modulus from linear rheology which characterizes thermal relaxation of glassy particle clusters in the zero strain limit. The linear and non-linear measurements are compared against a recently developed mechanical theory for colloidal glasses.
Modeling the summertime evolution of sea-ice melt ponds
DEFF Research Database (Denmark)
Lüthje, Mikael; Feltham, D.L.; Taylor, P.D.
2006-01-01
We present a mathematical model describing the summer melting of sea ice. We simulate the evolution of melt ponds and determine area coverage and total surface ablation. The model predictions are tested for sensitivity to the melt rate of unponded ice, enhanced melt rate beneath the melt ponds...
Modeling of nuclear waste disposal by rock melting
International Nuclear Information System (INIS)
Heuze, F.E.
1982-04-01
Today, the favored option for disposal of high-level nuclear wastes is their burial in mined caverns. As an alternative, the concept of deep disposal by rock melting (DRM) also has received some attention. DRM entails the injection of waste, in a cavity or borehole, 2 to 3 kilometers down in the earth crust. Granitic rocks are the prime candidate medium. The high thermal loading initially will melt the rock surrounding the waste. Following resolidification, a rock/waste matrix is formed, which should provide isolation for many years. The complex thermal, mechanical, and hydraulic aspects of DRM can be studied best by means of numerical models. The models must accommodate the coupling of the physical processes involved, and the temperature dependency of the granite properties, some of which are subject to abrupt discontinuities, during α-β phase transition and melting. This paper outlines a strategy for such complex modeling
Lattice Boltzmann model for melting with natural convection
International Nuclear Information System (INIS)
Huber, Christian; Parmigiani, Andrea; Chopard, Bastien; Manga, Michael; Bachmann, Olivier
2008-01-01
We develop a lattice Boltzmann method to couple thermal convection and pure-substance melting. The transition from conduction-dominated heat transfer to fully-developed convection is analyzed and scaling laws and previous numerical results are reproduced by our numerical method. We also investigate the limit in which thermal inertia (high Stefan number) cannot be neglected. We use our results to extend the scaling relations obtained at low Stefan number and establish the correlation between the melting front propagation and the Stefan number for fully-developed convection. We conclude by showing that the model presented here is particularly well-suited to study convection melting in geometrically complex media with many applications in geosciences
An Explanation for the Arctic Sea Ice Melt Pond Fractal Transition
Popovic, P.; Abbot, D. S.
2016-12-01
As Arctic sea ice melts during the summer, pools of melt water form on its surface. This decreases the ice's albedo, which signifcantly impacts its subsequent evolution. Understanding this process is essential for buiding accurate sea ice models in GCMs and using them to forecast future changes in sea ice. A feature of melt ponds that helps determine their impact on ice albedo is that they often form complex geometric shapes. One characteristic of their shape, the fractal dimension of the pond boundaries, D, has been shown to transition between the two fundamental limits of D = 1 and D = 2 at some critical pond size. Here, we provide an explanation for this behavior. First, using aerial photographs taken during the SHEBA mission, we show how this fractal transition curve changes with time, and show that there is a qualitative difference in the pond shape as ice transitions from impermeable to permeable. While ice is impermeable, the maximum fractal dimension is less than 2, whereas after it becomes permeable, the maximum fractal dimension becomes very close to 2. We then show how the fractal dimension of the boundary of a collection of overlapping circles placed randomly on a plane also transitions from D = 1 to D = 2 at a size equal to the average size of a single circle. We, therefore, conclude that this transition is a simple geometric consequence of regular shapes connecting. The one physical parameter that can be extracted from the fractal transition curve is the length scale at which transition occurs. Previously, this length scale has been associated with the typical size of snow dunes created on the ice surface during winter. We provide an alternative explanation by noting that the flexural wavelength of the ice poses a fundamental limit on the size of melt ponds on permeable ice. If this is true, melt ponds could be used as a proxy for ice thickness. Finally, we provide some remarks on how to observationally distinguish between the two ideas for what
Bochmann, Esther S; Steffens, Kristina E; Gryczke, Andreas; Wagner, Karl G
2018-03-01
Simulation of HME processes is a valuable tool for increased process understanding and ease of scale-up. However, the experimental determination of all required input parameters is tedious, namely the melt rheology of the amorphous solid dispersion (ASD) in question. Hence, a procedure to simplify the application of hot-melt extrusion (HME) simulation for forming amorphous solid dispersions (ASD) is presented. The commercial 1D simulation software Ludovic ® was used to conduct (i) simulations using a full experimental data set of all input variables including melt rheology and (ii) simulations using model-based melt viscosity data based on the ASDs glass transition and the physical properties of polymeric matrix only. Both types of HME computation were further compared to experimental HME results. Variation in physical properties (e.g. heat capacity, density) and several process characteristics of HME (residence time distribution, energy consumption) among the simulations and experiments were evaluated. The model-based melt viscosity was calculated by using the glass transition temperature (T g ) of the investigated blend and the melt viscosity of the polymeric matrix by means of a T g -viscosity correlation. The results of measured melt viscosity and model-based melt viscosity were similar with only few exceptions, leading to similar HME simulation outcomes. At the end, the experimental effort prior to HME simulation could be minimized and the procedure enables a good starting point for rational development of ASDs by means of HME. As model excipients, Vinylpyrrolidone-vinyl acetate copolymer (COP) in combination with various APIs (carbamazepine, dipyridamole, indomethacin, and ibuprofen) or polyethylene glycol (PEG 1500) as plasticizer were used to form the ASDs. Copyright © 2017 Elsevier B.V. All rights reserved.
Dihedral angle of carbonatite melts in mantle residue near the upper mantle and transition zone
Ghosh, S. K.; Rohrbach, A.; Schmidt, M. W.
2015-12-01
Carbonate melts are thought to be ideal metasomatic agents in the deep upper mantle (Green & Wallace, 1988) and these melts are low in viscosities (10-1-10-3 Pa·s) compared to primitive basalt (101-102 Pa·s), furthermore the ability to form an interconnected grain-edge melt network at low melt fractions (3 GPa (Dasgupta et al. 2006, Ghosh et al., 2009), dissolve a number of geochemically incompatible elements much better than silicate melts (Blundy and Dalton, 2000). Previous studies of carbonate melt dihedral angles in olivine-dominated matrices yielded 25-30oat 1-3 GPa, relatively independent of melt composition (Watson et al., 1990) and temperature (Hunter and McKenzie, 1989). Dihedral angles of carbonate melts in contact with deep mantle silicate phases (e.g. garnet, wadsleyite, and ringwoodite) which constitute more than 70 % of the deep upper mantle and transition zone have not been studied yet. We have performed multi-anvil experiments on carbonate-bearing peridotites with 5.0 wt% CO2 from 13.5 to 20 GPa 1550 oC to investigate the dihedral angle of magnesio-carbonatite melts in equilibrium with garnet, olivine (and its high-pressure polymorphs), and clinoenstatite. The dihedral angle of carbonate melts in the deep upper mantle and transition zone is ~30° for majorite garnet and olivine (and its polymorphs) dominated matrices. It does not change with increasing pressure in the range 13.5-20 GPa. Our results suggest that very low melt fractions of carbonatite melt forming in the deep upper mantle and transition zone are interconnected at melt fractions less than 0.01. Consistent with geophysical observations, this could possibly explain low velocity regions in the deep mantle and transition zone.
Glass Transition, Crystallization of Glass-Forming Melts, and Entropy
Directory of Open Access Journals (Sweden)
Jürn W. P. Schmelzer
2018-02-01
Full Text Available A critical analysis of possible (including some newly proposed definitions of the vitreous state and the glass transition is performed and an overview of kinetic criteria of vitrification is presented. On the basis of these results, recent controversial discussions on the possible values of the residual entropy of glasses are reviewed. Our conclusion is that the treatment of vitrification as a process of continuously breaking ergodicity with entropy loss and a residual entropy tending to zero in the limit of zero absolute temperature is in disagreement with the absolute majority of experimental and theoretical investigations of this process and the nature of the vitreous state. This conclusion is illustrated by model computations. In addition to the main conclusion derived from these computations, they are employed as a test for several suggestions concerning the behavior of thermodynamic coefficients in the glass transition range. Further, a brief review is given on possible ways of resolving the Kauzmann paradox and its implications with respect to the validity of the third law of thermodynamics. It is shown that neither in its primary formulations nor in its consequences does the Kauzmann paradox result in contradictions with any basic laws of nature. Such contradictions are excluded by either crystallization (not associated with a pseudospinodal as suggested by Kauzmann or a conventional (and not an ideal glass transition. Some further so far widely unexplored directions of research on the interplay between crystallization and glass transition are anticipated, in which entropy may play—beyond the topics widely discussed and reviewed here—a major role.
Modeling for Transition Management
Chappin, Emile J L; Dijkema, Gerard P.J.
2015-01-01
A framework for the modeling and simulation of transitions is presented. A transition, “substantial change in the state of a socio-technical system”, typically unfolds over a long timespan. We therefore suggest to use simulation to inform transition managers on the effect of their decisions.
Model of fracture of metal melts and the strength of melts under dynamic conditions
International Nuclear Information System (INIS)
Mayer, P. N.; Mayer, A. E.
2015-01-01
The development of a continuum model of deformation and fracture of melts is needed for the description of the behavior of metals in extreme states, in particular, under high-current electron and ultrashort laser irradiation. The model proposed includes the equations of mechanics of a two-phase continuum and the equations of the kinetics of phase transitions. The change (exchange) of the volumes of dispersed and carrier phases and of the number of dispersed particles is described, and the energy and mass exchange between the phases due to phase transitions is taken into account. Molecular dynamic (MD) calculations are carried out with the use of the LAMMPS program. The continuum model is verified by MD, computational, and experimental data. The strength of aluminum, copper, and nickel is determined at various temperatures and strain rates. It is shown that an increase in the strain rate leads to an increase in the strength of a liquid metal, while an increase in temperature leads to a decrease in its strength
Discrete elastic model for two-dimensional melting
Lansac, Yves; Glaser, Matthew A.; Clark, Noel A.
2006-04-01
We present a network model for the study of melting and liquid structure in two dimensions, the first in which the presence and energy of topological defects (dislocations and disclinations) and of geometrical defects (elemental voids) can be independently controlled. Interparticle interaction is via harmonic springs and control is achieved by Monte Carlo moves which springs can either be orientationally “flipped” between particles to generate topological defects, or can be “popped” in force-free shape, to generate geometrical defects. With the geometrical defects suppressed the transition to the liquid phase occurs via disclination unbinding, as described by the Kosterlitz-Thouless-Halperin-Nelson-Young model and found in soft potential two-dimensional (2D) systems, such as the dipole-dipole potential [H. H. von Grünberg , Phys. Rev. Lett. 93, 255703 (2004)]. By contrast, with topological defects suppressed, a disordering transition, the Glaser-Clark condensation of geometrical defects [M. A. Glaser and N. A. Clark, Adv. Chem. Phys. 83, 543 (1993); M. A. Glaser , Springer Proceedings in Physics: Dynamics and Patterns in Complex Fluids (Springer-Verlag, Berlin, 1990), Vol. 52, p. 141], produces a state that accurately characterizes the local liquid structure and first-order melting observed in hard-potential 2D systems, such as hard disk and the Weeks-Chandler-Andersen (WCA) potentials (M. A. Glaser and co-workers, see above). Thus both the geometrical and topological defect systems play a role in melting. The present work introduces a system in which the relative roles of topological and geometrical defects and their interactions can be explored. We perform Monte Carlo simulations of this model in the isobaric-isothermal ensemble, and present the phase diagram as well as various thermodynamic, statistical, and structural quantities as a function of the relative populations of geometrical and topological defects. The model exhibits a rich phase behavior
Chremos, Alexandros; Glynos, Emmanouil; Green, Peter F.
2015-01-01
Structural and dynamical properties of star melts have been investigated with molecular dynamics simulations of a bead-spring model. Star polymers are known to be heterogeneous, but a systematic simulation study of their properties in melt conditions near the glass transition temperature was lacking. To probe their properties, we have expanded from linear to star polymers the applicability of Dobkowski's chain-length dependence correlation function [Z. Dobkowski, Eur. Polym. J. 18, 563 (1982)]. The density and the isokinetic temperature, based on the canonical definition of the laboratory glass-transition, can be described well by the correlation function and a subtle behavior manifests as the architecture becomes more complex. For linear polymer chains and low functionality star polymers, we find that an increase of the arm length would result in an increase of the density and the isokinetic temperature, but high functionality star polymers have the opposite behavior. The effect between low and high functionalities is more pronounced for short arm lengths. Complementary results such as the specific volume and number of neighbors in contact provide further insights on the subtle relation between structure and dynamics. The findings would be valuable to polymer, colloidal, and nanocomposites fields for the design of materials in absence of solution with the desired properties.
Shear viscosity of glass-forming melts in the liquid-glass transition region
International Nuclear Information System (INIS)
Sanditov, D. S.
2010-01-01
A new approach to interpreting the hole-activation model of a viscous flow of glass-forming liquids is proposed. This model underlies the development of the concept on the exponential temperature dependence of the free energy of activation of a flow within the range of the liquid-glass transition in complete agreement with available experimental data. The 'formation of a fluctuation hole' in high-heat glass-forming melts is considered as a small-scale low-activation local deformation of a structural network, i.e., the quasi-lattice necessary for the switching of the valence bond, which is the main elementary event of viscous flow of glasses and their melts. In this sense, the hole formation is a conditioned process. A drastic increase in the activation free energy of viscous flow in the liquid-glass transition region is explained by a structural transformation that is reduced to a limiting local elastic deformation of the structural network, which, in turn, originates from the excitation (critical displacement) of a bridging atom like the oxygen atom in the Si-O-Si bridge. At elevated temperatures, as a rule, a necessary amount of excited bridging atoms (locally deformed regions of the structural network) always exists, and the activation free energy of viscous flow is almost independent of temperature. The hole-activation model is closely connected with a number of well-known models describing the viscous flow of glass-forming liquids (the Avramov-Milchev, Nemilov, Ojovan, and other models).
Transitive probabilistic CLIR models.
Kraaij, W.; de Jong, Franciska M.G.
2004-01-01
Transitive translation could be a useful technique to enlarge the number of supported language pairs for a cross-language information retrieval (CLIR) system in a cost-effective manner. The paper describes several setups for transitive translation based on probabilistic translation models. The
Indication of liquid-liquid phase transition in CuZr-based melts
DEFF Research Database (Denmark)
Zhou, C.; Hu, L.N.; Sun, Q.J.
2013-01-01
We study the dynamic behavior of CuZr-based melts well above the liquidus temperature. The results show a discontinuous change in viscosity during cooling, which is attributed to an underlying liquid-liquid phase transition (LLPT) in these melts. The LLPT is further verified by thermodynamic resp...... liquids to the weakly ordered low-density liquids upon cooling.......We study the dynamic behavior of CuZr-based melts well above the liquidus temperature. The results show a discontinuous change in viscosity during cooling, which is attributed to an underlying liquid-liquid phase transition (LLPT) in these melts. The LLPT is further verified by thermodynamic...... response in the same superheated region. We find that the LLPT in the Cu46Zr46Al8 melt is reversible above 1350 K upon repeated heating and cooling. Based on the concept of fluid clustering in metallic melts, the reversible LLPT is attributed to the structural transition from the strongly ordered high-density...
Deng, Zhenyu; Jiang, Yangwei; He, Linli; Zhang, Linxi
2016-11-10
By employing molecular dynamics simulations, we explored the conformation transition of nanoparticles (NPs) in semiflexible ring polymer nanocomposite melts. A novel aggregation-dispersion transition for NPs in ring polymer nanocomposites occurs when the bending energy of ring chains increases. The conformations of flexible ring chains near NPs are radial distribution, and the entropic depletion interactions between a pair of NPs in flexible ring polymer nanocomposite melts are attractive, however, the rod-like ring chains wrap around the NPs and the entropic depletion interactions between NPs in rod-like ring polymer melts are repulsive. The aggregation-dispersion transition for NPs induced by chain topology in polymer nanocomposites can provide a new access to achieve miscibility in producing high-performance polymer-nanoparticle composites by simply varying the topological structure of polymers.
Mysen, Bjorn O.
2008-10-01
The two most abundant network-modifying cations in magmatic liquids are Ca 2+ and Mg 2+. To evaluate the influence of melt structure on exchange of Ca 2+ and Mg 2+ with other geochemically important divalent cations ( m-cations) between coexisting minerals and melts, high-temperature (1470-1650 °C), ambient-pressure (0.1 MPa) forsterite/melt partitioning experiments were carried out in the system Mg 2SiO 4-CaMgSi 2O 6-SiO 2 with ⩽1 wt% m-cations (Mn 2+, Co 2+, and Ni 2+) substituting for Ca 2+ and Mg 2+. The bulk melt NBO/Si-range ( NBO/Si: nonbridging oxygen per silicon) of melt in equilibrium with forsterite was between 1.89 and 2.74. In this NBO/Si-range, the NBO/Si(Ca) (fraction of nonbridging oxygens, NBO, that form bonds with Ca 2+, Ca 2+- NBO) is linearly related to NBO/Si, whereas fraction of Mg 2+- NBO bonds is essentially independent of NBO/Si. For individual m-cations, rate of change of KD( m-Mg) with NBO/Si(Ca) for the exchange equilibrium, mmelt + Mg olivine ⇌ molivine + Mg melt, is linear. KD( m-Mg) decreases as an exponential function of increasing ionic potential, Z/ r2 ( Z: formal electrical charge, r: ionic radius—here calculated with oxygen in sixfold coordination around the divalent cations) of the m-cation. The enthalpy change of the exchange equilibrium, Δ H, decreases linearly with increasing Z/ r2 [Δ H = 261(9)-81(3)· Z/ r2 (Å -2)]. From existing information on (Ca,Mg)O-SiO 2 melt structure at ambient pressure, these relationships are understood by considering the exchange of divalent cations that form bonds with nonbridging oxygen in individual Qn-species in the melts. The negative ∂ KD( m-Mg) /∂( Z/ r2) and ∂(Δ H)/∂( Z/ r2) is because increasing Z/ r2 is because the cations forming bonds with nonbridging oxygen in increasingly depolymerized Qn-species where steric hindrance is decreasingly important. In other words, principles of ionic size/site mismatch commonly observed for trace and minor elements in crystals, also
Collective modes in simple melts: Transition from soft spheres to the hard sphere limit.
Khrapak, Sergey; Klumov, Boris; Couëdel, Lénaïc
2017-08-11
We study collective modes in a classical system of particles with repulsive inverse-power-law (IPL) interactions in the fluid phase, near the fluid-solid coexistence (IPL melts). The IPL exponent is varied from n = 10 to n = 100 to mimic the transition from moderately soft to hard-sphere-like interactions. We compare the longitudinal dispersion relations obtained using molecular dynamic (MD) simulations with those calculated using the quasi-crystalline approximation (QCA) and find that this simple theoretical approach becomes grossly inaccurate for [Formula: see text]. Similarly, conventional expressions for high-frequency (instantaneous) elastic moduli, predicting their divergence as n increases, are meaningless in this regime. Relations of the longitudinal and transverse elastic velocities of the QCA model to the adiabatic sound velocity, measured in MD simulations, are discussed for the regime where QCA is applicable. Two potentially useful freezing indicators for classical particle systems with steep repulsive interactions are discussed.
Shape and Symmetry Determine Two-Dimensional Melting Transitions of Hard Regular Polygons
Anderson, Joshua A.; Antonaglia, James; Millan, Jaime A.; Engel, Michael; Glotzer, Sharon C.
2017-04-01
The melting transition of two-dimensional systems is a fundamental problem in condensed matter and statistical physics that has advanced significantly through the application of computational resources and algorithms. Two-dimensional systems present the opportunity for novel phases and phase transition scenarios not observed in 3D systems, but these phases depend sensitively on the system and, thus, predicting how any given 2D system will behave remains a challenge. Here, we report a comprehensive simulation study of the phase behavior near the melting transition of all hard regular polygons with 3 ≤n ≤14 vertices using massively parallel Monte Carlo simulations of up to 1 ×106 particles. By investigating this family of shapes, we show that the melting transition depends upon both particle shape and symmetry considerations, which together can predict which of three different melting scenarios will occur for a given n . We show that systems of polygons with as few as seven edges behave like hard disks; they melt continuously from a solid to a hexatic fluid and then undergo a first-order transition from the hexatic phase to the isotropic fluid phase. We show that this behavior, which holds for all 7 ≤n ≤14 , arises from weak entropic forces among the particles. Strong directional entropic forces align polygons with fewer than seven edges and impose local order in the fluid. These forces can enhance or suppress the discontinuous character of the transition depending on whether the local order in the fluid is compatible with the local order in the solid. As a result, systems of triangles, squares, and hexagons exhibit a Kosterlitz-Thouless-Halperin-Nelson-Young (KTHNY) predicted continuous transition between isotropic fluid and triatic, tetratic, and hexatic phases, respectively, and a continuous transition from the appropriate x -atic to the solid. In particular, we find that systems of hexagons display continuous two-step KTHNY melting. In contrast, due to
Shape and Symmetry Determine Two-Dimensional Melting Transitions of Hard Regular Polygons
Directory of Open Access Journals (Sweden)
Joshua A. Anderson
2017-04-01
Full Text Available The melting transition of two-dimensional systems is a fundamental problem in condensed matter and statistical physics that has advanced significantly through the application of computational resources and algorithms. Two-dimensional systems present the opportunity for novel phases and phase transition scenarios not observed in 3D systems, but these phases depend sensitively on the system and, thus, predicting how any given 2D system will behave remains a challenge. Here, we report a comprehensive simulation study of the phase behavior near the melting transition of all hard regular polygons with 3≤n≤14 vertices using massively parallel Monte Carlo simulations of up to 1×10^{6} particles. By investigating this family of shapes, we show that the melting transition depends upon both particle shape and symmetry considerations, which together can predict which of three different melting scenarios will occur for a given n. We show that systems of polygons with as few as seven edges behave like hard disks; they melt continuously from a solid to a hexatic fluid and then undergo a first-order transition from the hexatic phase to the isotropic fluid phase. We show that this behavior, which holds for all 7≤n≤14, arises from weak entropic forces among the particles. Strong directional entropic forces align polygons with fewer than seven edges and impose local order in the fluid. These forces can enhance or suppress the discontinuous character of the transition depending on whether the local order in the fluid is compatible with the local order in the solid. As a result, systems of triangles, squares, and hexagons exhibit a Kosterlitz-Thouless-Halperin-Nelson-Young (KTHNY predicted continuous transition between isotropic fluid and triatic, tetratic, and hexatic phases, respectively, and a continuous transition from the appropriate x-atic to the solid. In particular, we find that systems of hexagons display continuous two-step KTHNY melting. In
Study of melting of molecular crystals by a modified Pople-Karasz model
Yazıcı, Mustafa; Özgan, Şükrü; Keskin, Mustafa
2005-02-01
A new modified model that combines the modified models of Chandrasekhar et al. with those of Keskin and Özgan, which are based on the Pople-Karasz theory, is applied to study the thermodynamics of melting and solid-solid transitions of molecular crystals. The thermodynamic properties of the disordered system are evaluated relative to those of the perfectly ordered one using the lowest approximation of the cluster-variation method, which is identical to the mean-field approximation. A good agreement is found between the present modified theory and the available experimental data. For melting transitions the agreement is excellent and much better than with the calculations of the Pople-Karasz theory and its previous modified theories. Approximate agreement is obtained for the solid-solid transitions. However, for these transition the experimental agreement with the present modified theory is still better than previous modified theories except at zero and low pressures.
A multi-component evaporation model for beam melting processes
Klassen, Alexander; Forster, Vera E.; Körner, Carolin
2017-02-01
In additive manufacturing using laser or electron beam melting technologies, evaporation losses and changes in chemical composition are known issues when processing alloys with volatile elements. In this paper, a recently described numerical model based on a two-dimensional free surface lattice Boltzmann method is further developed to incorporate the effects of multi-component evaporation. The model takes into account the local melt pool composition during heating and fusion of metal powder. For validation, the titanium alloy Ti-6Al-4V is melted by selective electron beam melting and analysed using mass loss measurements and high-resolution microprobe imaging. Numerically determined evaporation losses and spatial distributions of aluminium compare well with experimental data. Predictions of the melt pool formation in bulk samples provide insight into the competition between the loss of volatile alloying elements from the irradiated surface and their advective redistribution within the molten region.
International Nuclear Information System (INIS)
Zakir'yanova, I.D.; Salyulev, A.B.
2007-01-01
Systematic structural studies of crystalline (over a wide temperature range) and molten LaCl 3 , CeCl 3 , and NdCl 3 salts (near the crystal-melt phase transition temperature) are conducted employing Raman spectroscopy. A change in the trend of temperature dependences of characteristic frequencies is revealed in the pre-melting region of the compounds. This is attributed to an increase in the number of crystal defects due to weakening of a part of Ln-Cl bonds and decreasing of coordination number of chloride anions in the vicinity of rare earth cation [ru
A 2D double-porosity model for melting and melt migration beneath mid-oceanic ridges
Liu, B.; Liang, Y.; Parmentier, E.
2017-12-01
Several lines of evidence suggest that the melting and melt extraction region of the MORB mantle is heterogeneous consisting of an interconnected network of high permeability dunite channels in a low porosity harzburgite or lherzolite matrix. In principle, one can include channel formation into the tectonic-scale geodynamic models by solving conservation equations for a chemically reactive and viscously deformable porous medium. Such an approach eventually runs into computational limitations such as resolving fractal-like channels that have a spectrum of width. To better understand first order features of melting and melt-rock interaction beneath MOR, we have formulated a 2D double porosity model in which we treat the triangular melting region as two overlapping continua occupied by the low-porosity matrix and interconnected high-porosity channels. We use melt productivity derived from a thermodynamic model and melt suction rate to close our problem. We use a high-order accurate numerical method to solve the conservation equations in 2D for porosity, solid and melt velocities and concentrations of chemical tracers in the melting region. We carry out numerical simulations to systematically study effects of matrix-to-channel melt suction and spatially distributed channels on the distributions of porosity and trace element and isotopic ratios in the melting region. For near fractional melting with 10 vol% channel in the melting region, the flow field of the matrix melt follows closely to that of the solid because the small porosity (exchange between the melt and the solid. The smearing effect can be approximated by dispersion coefficient. For slowly diffusing trace elements (e.g., LREE and HFSE), the melt migration induced dispersion can be as effective as thermal diffusion. Therefore, sub-kilometer scale heterogeneities of Nd and Hf isotopes are significantly damped or homogenized in the melting region.
Modeling the viscosity of silicate melts containing manganese oxide
Directory of Open Access Journals (Sweden)
Kim Wan-Yi
2013-01-01
Full Text Available Our recently developed model for the viscosity of silicate melts is applied to describe and predict the viscosities of oxide melts containing manganese oxide. The model requires three pairs of adjustable parameters that describe the viscosities in three systems: pure MnO, MnO-SiO2 and MnO-Al2O3-SiO2. The viscosity of other ternary and multicomponent silicate melts containing MnO is then predicted by the model without any additional adjustable model parameters. Experimental viscosity data are reviewed for melts formed by MnO with SiO2, Al2O3, CaO, MgO, PbO, Na2O and K2O. The deviation of the available experimental data from the viscosities predicted by the model is shown to be within experimental error limits.
Viscosity of Heterogeneous Silicate Melts: A Non-Newtonian Model
Liu, Zhuangzhuang; Blanpain, Bart; Guo, Muxing
2017-12-01
The recently published viscosity data of heterogeneous silicate melts with well-documented structure and experimental conditions are critically re-analyzed and tabulated. By using these data, a non-Newtonian viscosity model incorporating solid fraction, solid shape, and shear rate is proposed on the basis of the power-law equation. This model allows calculating the viscosity of the heterogeneous silicate melts with solid fraction up to 34 vol pct. The error between the calculated and measured data is evaluated to be 32 pct, which is acceptable considering the large error in viscosity measurement of the completely liquid silicate melt.
DEFF Research Database (Denmark)
Hervig, K.W.; Wu, Z.; Dai, P.
1997-01-01
neutron diffraction experiments. Butane melts abruptly to a liquid phase where the molecules in the trans conformation translationally diffuse while rotating about their center of mass. In the case of the hexane monolayer, the MD simulations show that the appearance of quasielastic scattering below T-m...... coincides with transformation of Some molecules from trans to gauche conformations. Furthermore, if gauche molecules are prevented from forming in the simulation, the calculated incoherent scattering function contains no quasielastic component below T-m. Modeling of both the neutron and simulated hexane......Quasielastic neutron scattering experiments and molecular dynamics (MD) simulations have been used to investigate molecular diffusive motion near the melting transition of monolayers of flexible rod-shaped molecules. The experiments were conducted on butane and hexane monolayers adsorbed...
Mathematical modeling of melting during laser heating of metal plate
Directory of Open Access Journals (Sweden)
Purin Mikhail
2017-01-01
Full Text Available The mathematical modeling of heat transfer processes proceeding together under the conditions of intense phase transformations (melting and metal evaporation under laser action on a metal plate has been carried out. The analysis of the results has showed that increasing of the laser radiation (ql power leads to acceleration of the melting process. However, it has been found that the change in the melting dynamics with variation of ql is characteristic only for the plates made of iron and copper. At the same time, it has been found that an increase in ql does not affect significantly the melting rate of the aluminum plates. It has been established that when the laser is exposed to a plate, zones with large temperature gradients are formed which can cause thermal stresses.
Experimental investigation of spreading model melts in presence of solidification
International Nuclear Information System (INIS)
Kraut, S.; Siegel, U.; Ehrhard, P.
1997-12-01
The complete spreading of the corium melt on the spreading area of the EPR has to be viewed as a basis for coolability. To understand the basic phenomena of spreading and solidification, model experiments have been performed using Woodsmetal (MCP58) as model melt. The melt is spreading on a horizontal plate, which is kept at constant temperature. Thus, for plate temperatures below the solidification temperature of the melt (T W ≤60 C) substantial solidification is obtained on the plate during spreading. Three series of experiments have been performed, covering the range of Reynolds-numbers 3,76≤Re≤39,92. The plate temperature has been varied within each series in the range 40 C≤T W ≤75 C. The Prandtl-number of the melt is Pr=0.74. We find for T W ≥60 C pure hydrodynamic spreading without solidification, featuring the typical properties of inertia-dominated spreading. For T W [de
On the glass transition of the one-component metallic melts
Czech Academy of Sciences Publication Activity Database
Fedorchenko, Alexander I.
2017-01-01
Roč. 475, October (2017), s. 362-367 ISSN 0022-0248 Institutional support: RVO:61388998 Keywords : equilibrium and non-equilibrium solidification * criterion of the phase transition scenario * one-component metal melts Subject RIV: BJ - Thermodynamics OBOR OECD: Thermodynamics Impact factor: 1.751, year: 2016 http://ac.els-cdn.com/S0022024817304281/1-s2.0-S0022024817304281-main.pdf?_tid=a12ba97e-873b-11e7-b6be-00000aacb35e&acdnat=1503407763_5cdbcdb15d504baf5f8dfb94886b3100
Czech Academy of Sciences Publication Activity Database
Hrbek, L.; Kocourková, P.; Jebavá, Marcela; Cincibusová, P.; Němec, Lubomír
2017-01-01
Roč. 456, JAN 15 (2017), s. 101-113 ISSN 0022-3093 Institutional support: RVO:67985891 Keywords : glass melt flow * mathematical modelling * energy distribution * space utilization * melting performance Subject RIV: JH - Ceramics, Fire-Resistant Materials and Glass OBOR OECD: Ceramics Impact factor: 2.124, year: 2016
Numerical Model based Reliability Estimation of Selective Laser Melting Process
DEFF Research Database (Denmark)
Mohanty, Sankhya; Hattel, Jesper Henri
2014-01-01
Selective laser melting is developing into a standard manufacturing technology with applications in various sectors. However, the process is still far from being at par with conventional processes such as welding and casting, the primary reason of which is the unreliability of the process. While...... of the selective laser melting process. A validated 3D finite-volume alternating-direction-implicit numerical technique is used to model the selective laser melting process, and is calibrated against results from single track formation experiments. Correlation coefficients are determined for process input...... parameters such as laser power, speed, beam profile, etc. Subsequently, uncertainties in the processing parameters are utilized to predict a range for the various outputs, using a Monte Carlo method based uncertainty analysis methodology, and the reliability of the process is established....
Population balance modelling of fluidized bed melt granulation: an overview
Tan, H.S.; Goldschmidt, M.J.V.; Boerefijn, R.; Hounslow, M.J.; Salman, A.; Kuipers, J.A.M.
2005-01-01
This paper presents an overview of the work undertaken by our group to identify and quantify the rates processes active in fluidized bed melt granulation (FBMG). The process involves the identification and development of physically representative models to mechanistically describe FBMG using both
Residence time modeling of hot melt extrusion processes.
Reitz, Elena; Podhaisky, Helmut; Ely, David; Thommes, Markus
2013-11-01
The hot melt extrusion process is a widespread technique to mix viscous melts. The residence time of material in the process frequently determines the product properties. An experimental setup and a corresponding mathematical model were developed to evaluate residence time and residence time distribution in twin screw extrusion processes. The extrusion process was modeled as the convolution of a mass transport process described by a Gaussian probability function, and a mixing process represented by an exponential function. The residence time of the extrusion process was determined by introducing a tracer at the extruder inlet and measuring the tracer concentration at the die. These concentrations were fitted to the residence time model, and an adequate correlation was found. Different parameters were derived to characterize the extrusion process including the dead time, the apparent mixing volume, and a transport related axial mixing. A 2(3) design of experiments was performed to evaluate the effect of powder feed rate, screw speed, and melt viscosity of the material on the residence time. All three parameters affect the residence time of material in the extruder. In conclusion, a residence time model was developed to interpret experimental data and to get insights into the hot melt extrusion process. Copyright © 2013 Elsevier B.V. All rights reserved.
Modelling elongational and shear rheology of two LDPE melts
Czech Academy of Sciences Publication Activity Database
Rolón-Garrido, V. H.; Pivokonský, Radek; Filip, Petr; Zatloukal, M.; Wagner, M. H.
2009-01-01
Roč. 48, č. 6 (2009), s. 691-697 ISSN 0035-4511 R&D Projects: GA AV ČR IAA200600703 Institutional research plan: CEZ:AV0Z20600510 Keywords : Rheology * MSF model * Shear flow * Elongational flow * Strain hardening * Low-density polyethylene * Polymer melts Subject RIV: BK - Fluid Dynamics Impact factor: 1.882, year: 2009
Computationally efficient thermal-mechanical modelling of selective laser melting
Yang, Y.; Ayas, C.; Brabazon, Dermot; Naher, Sumsun; Ul Ahad, Inam
2017-01-01
The Selective laser melting (SLM) is a powder based additive manufacturing (AM) method to produce high density metal parts with complex topology. However, part distortions and accompanying residual stresses deteriorates the mechanical reliability of SLM products. Modelling of the SLM process is
The glass transition, crystallization and melting in Au-Pb-Sb alloys
Lee, M. C.; Allen, J. L.; Fecht, H. J.; Perepezko, J. H.; Ohsaka, K.
1988-01-01
The glass transition, crystallization and melting of Au(55)Pb(22.5)Sb(22.5) alloys have been studied by differential scanning calorimetry DSC. Crystallization on heating above the glass transition temperature Tg (45 C) begins at 64 C. Further crystallization events are observed at 172 C and 205 C. These events were found to correspond to the formation of the intermetallic compounds AuSb2, Au2Pb, and possibly AuPb2, respectively. Isothermal DSC scans of the glassy alloy above Tg were used to monitor the kinetics of crystallization. The solidification behavior and heat capacity in the glass-forming composition range were determined with droplet samples. An undercooling level of 0.3T(L) below the liquidus temperature T(L) was achieved, resulting in crystallization of different stable and metastable phases. The heat capacity C(P) of the undercooled liquid was measured over an undercooling range of 145 C.
Melting scenario of the two-dimensional core-softened system: first-order or continuous transition?
International Nuclear Information System (INIS)
Dudalov, D E; Fomin, Yu D; Tsiok, E N; Ryzhov, V N
2014-01-01
We present a computer simulation study of the phase behavior of two-dimensional classical particles repelling each other through an isotropic core-softened potential. As in the analogous three dimensional case, a reentrant-melting transition occurs upon compression for not too high pressures. However, in two dimensions in the low density part of the phase diagram melting is a continuous two-stage transition, with an intermediate hexatic phase. All available evidence supports the Kosterlitz-Thouless-Halperin-Nelson-Young (KTHNY) scenario for this melting transition. On the other hand, at high density part of the phase diagram one first-order transition takes place. We expect that such a phenomenology can be checked in confined monolayers of charge-stabilized colloids with a softened core and water confined between two hydrophobic plates.
Supersaturating silicon with transition metals by ion implantation and pulsed laser melting
International Nuclear Information System (INIS)
Recht, Daniel; Aziz, Michael J.; Smith, Matthew J.; Gradečak, Silvija; Charnvanichborikarn, Supakit; Williams, James S.; Sullivan, Joseph T.; Winkler, Mark T.; Buonassisi, Tonio; Mathews, Jay; Warrender, Jeffrey M.
2013-01-01
We investigate the possibility of creating an intermediate band semiconductor by supersaturating Si with a range of transition metals (Au, Co, Cr, Cu, Fe, Pd, Pt, W, and Zn) using ion implantation followed by pulsed laser melting (PLM). Structural characterization shows evidence of either surface segregation or cellular breakdown in all transition metals investigated, preventing the formation of high supersaturations. However, concentration-depth profiling reveals that regions of Si supersaturated with Au and Zn are formed below the regions of cellular breakdown. Fits to the concentration-depth profile are used to estimate the diffusive speeds, v D, of Au and Zn, and put lower bounds on v D of the other metals ranging from 10 2 to 10 4 m/s. Knowledge of v D is used to tailor the irradiation conditions and synthesize single-crystal Si supersaturated with 10 19 Au/cm 3 without cellular breakdown. Values of v D are compared to those for other elements in Si. Two independent thermophysical properties, the solute diffusivity at the melting temperature, D s (T m ), and the equilibrium partition coefficient, k e , are shown to simultaneously affect v D . We demonstrate a correlation between v D and the ratio D s (T m )/k e 0.67 , which is exhibited for Group III, IV, and V solutes but not for the transition metals investigated. Nevertheless, comparison with experimental results suggests that D s (T m )/k e 0.67 might serve as a metric for evaluating the potential to supersaturate Si with transition metals by PLM
Supersaturating silicon with transition metals by ion implantation and pulsed laser melting
Energy Technology Data Exchange (ETDEWEB)
Recht, Daniel; Aziz, Michael J. [Harvard School of Engineering and Applied Sciences, Cambridge, Massachusetts 02138 (United States); Smith, Matthew J.; Gradečak, Silvija [Department of Materials Science and Engineering, Massachusetts Institute of Technology, Cambridge, Massachusetts 02139 (United States); Charnvanichborikarn, Supakit; Williams, James S. [Research School of Physics and Engineering, The Australian National University, Canberra, ACT (Australia); Sullivan, Joseph T.; Winkler, Mark T.; Buonassisi, Tonio [Department of Mechanical Engineering, Massachusetts Institute of Technology, Cambridge Massachusetts 02139 (United States); Mathews, Jay; Warrender, Jeffrey M. [Benet Laboratories, U.S. Army ARDEC, Watervliet, New York 12189 (United States)
2013-09-28
We investigate the possibility of creating an intermediate band semiconductor by supersaturating Si with a range of transition metals (Au, Co, Cr, Cu, Fe, Pd, Pt, W, and Zn) using ion implantation followed by pulsed laser melting (PLM). Structural characterization shows evidence of either surface segregation or cellular breakdown in all transition metals investigated, preventing the formation of high supersaturations. However, concentration-depth profiling reveals that regions of Si supersaturated with Au and Zn are formed below the regions of cellular breakdown. Fits to the concentration-depth profile are used to estimate the diffusive speeds, v{sub D,} of Au and Zn, and put lower bounds on v{sub D} of the other metals ranging from 10{sup 2} to 10{sup 4} m/s. Knowledge of v{sub D} is used to tailor the irradiation conditions and synthesize single-crystal Si supersaturated with 10{sup 19} Au/cm{sup 3} without cellular breakdown. Values of v{sub D} are compared to those for other elements in Si. Two independent thermophysical properties, the solute diffusivity at the melting temperature, D{sub s}(T{sub m}), and the equilibrium partition coefficient, k{sub e}, are shown to simultaneously affect v{sub D}. We demonstrate a correlation between v{sub D} and the ratio D{sub s}(T{sub m})/k{sub e}{sup 0.67}, which is exhibited for Group III, IV, and V solutes but not for the transition metals investigated. Nevertheless, comparison with experimental results suggests that D{sub s}(T{sub m})/k{sub e}{sup 0.67} might serve as a metric for evaluating the potential to supersaturate Si with transition metals by PLM.
Evaporation experiments and modelling for glass melts
Limpt, J.A.C. van; Beerkens, R.G.C.
2007-01-01
A laboratory test facility has been developed to measure evaporation rates of different volatile components from commercial and model glass compositions. In the set-up the furnace atmosphere, temperature level, gas velocity and batch composition are controlled. Evaporation rates have been measured
A model for pulsed laser melting of graphite
Steinbeck, J.; Braunstein, G.; Dresselhaus, M. S.; Venkatesan, T.; Jacobson, D. C.
1985-12-01
A model for laser melting of carbon at high temperatures to form liquid carbon has been developed. This model is solved numerically using experimental data from laser irradiation studies in graphite consistent with a melting temperature for graphite of 4300 K. The parameters for high-temperature graphite are based on the extension of previously measured thermal properties into the high-temperature regime. A simple classical free electron gas model is used to calculate the properties of liquid carbon. There is very good agreement between the model calculation and experimental results for laser pulse fluences below 2.0 J/cm2. Modifications to the model for larger laser pulse fluences are discussed.
Modeling Metropolitan Detroit transit.
2010-10-01
"The seven-county Southeast Michigan region, that encompasses the Detroit Metropolitan Area, : ranks fifth in population among top 25 regions in the nation. It also ranks among bottom five in : the transit service provided, measured in miles or hours...
In silico modeling of in situ fluidized bed melt granulation.
Aleksić, Ivana; Duriš, Jelena; Ilić, Ilija; Ibrić, Svetlana; Parojčić, Jelena; Srčič, Stanko
2014-05-15
Fluidized bed melt granulation has recently been recognized as a promising technique with numerous advantages over conventional granulation techniques. The aim of this study was to evaluate the possibility of using response surface methodology and artificial neural networks for optimizing in situ fluidized bed melt granulation and to compare them with regard to modeling ability and predictability. The experiments were organized in line with the Box-Behnken design. The influence of binder content, binder particle size, and granulation time on granule properties was evaluated. In addition to the response surface analysis, a multilayer perceptron neural network was applied for data modeling. It was found that in situ fluidized bed melt granulation can be used for production of spherical granules with good flowability. Binder particle size had the most pronounced influence on granule size and shape, suggesting the importance of this parameter in achieving desired granule properties. It was found that binder content can be a critical factor for the width of granule size distribution and yield when immersion and layering is the dominant agglomeration mechanism. The results obtained indicate that both in silico techniques can be useful tools in defining the design space and optimization of in situ fluidized bed melt granulation. Copyright © 2014 Elsevier B.V. All rights reserved.
DEFF Research Database (Denmark)
Else, B.G.T.; Papakyriakou, T.N.; Raddatz, R.
2014-01-01
Relatively few sea ice energy balance studies have successfully captured the transition season of warming, snowmelt, and melt pond formation. In this paper, we report a surface energy budget for landfast sea ice that captures this important period. The study was conducted in the Canadian Arctic......) combined with the seasonal increase in incoming shortwave radiation then triggered snowmelt onset. Melt progressed with a rapid reduction in albedo and attendant increases in shortwave energy absorption, resulting in melt pond formation 8 days later. The key role of longwave radiation in initiating melt...... onset supports past findings, and confirms the importance of clouds and water vapor associated with synoptic weather systems. However, we also observed a period of strong turbulent energy exchange associated with the passage of a cyclone. The cyclone event occurred shortly after melt pond formation...
A Structurally Based Viscosity Model for Oxide Melts
Zhang, Guo-Hua; Chou, Kuo-Chih; Mills, Ken
2014-04-01
A structurally based viscosity model is proposed to represent the viscosity of oxide melts as functions of both temperature and composition; The oxide melts cover the following constituents: Li2O, Na2O, K2O, MgO, CaO, SrO, BaO, FeO, MnO, Al2O3, SiO2, CaF2, TiO2, Fe2O3, and P2O5. The model describes the slag structure in terms of the various forms of oxygen ions which are classified according to the metal cations they bond with. Approximate methods for calculating the concentrations of these oxygen ions are proposed and are then used to describe the effect of melt structure on viscosity. The model provides a good description of the variations in viscosity with composition and temperature. The measured viscosities were compared with values calculated with the model, and the current model was found to provide reliable estimates of viscosities of slags used in various industrial processes ( e.g., blast furnace, basic oxygen steelmaking, ladle refining, continuous casting of steel, coal gasification, and electroslag remelting).
A vapour bubble collapse model to describe the fragmentation of low-melting materials
International Nuclear Information System (INIS)
Benz, R.; Schober, P.
1977-11-01
By means of a model, the fragmentation of a hot melt of metal in consequence of collapsing vapour-bubbles is investigated. In particular the paper deals with the development of the physical model-ideas for calculation of the temperature of contact that adjusts between the temperature of the melt and the coolant, of the waiting-time until bubble-nucleation occurs and of the maximal obtainable vapour-bubble-radius in dependence of the coolant-temperature. After that follows the description of the computing-program belonging to this model and of the results of an extensive parameter-study. The study examined the influence of the temperature of melt and coolant, the melted mass, the nucleation-site-density, the average maximum bubble-radius, the duration of film-breakdown and the coefficient of heat-transition. The calculation of the process of fragmentation turns out to be according to expectation, whereas the duration of this process seems to be somewhat too long. The dependence of the surface-enlargement on the subcooling of the water-bath and the initial temperature of the melt is not yet reproduced satisfactorily by the model. The reasons for this are the temperature-increase of the water-bath as well as the fact that the coupling of heat-flux-density and nucleation-site-density are not taken into consideration. Further improvement of the model is necessary and may improve the results in the sense of the experimental observations. (orig.) [de
International Nuclear Information System (INIS)
Kwok, W.K.; Fleshler, S.; Welp, U.; Downey, J.; Crabtree, G.W.; Fendrich, J. Giapintzakis, J.
1993-08-01
The vortex melting transition T m in several untwinned and twinned crystals measured resistively in fields up to 8 Tesla. A Lindemann criterion for vortex lattice melting is obtained in addition to a sharp hysteresis in the magnetoresistance at B m supporting a first order phase transition. The anisotropy of twin boundary pinning and its reduction of the ''kink'' in ρ(T) associated with the first order melting transition is discussed in samples with very dilute twin boundaries. We also report on direct suppression of melting transition by intrinsic pinning for H parallel ab and by electron-irradiation-induced point defects
Thresholds models of technological transitions
Zeppini, P.; Frenken, K.; Kupers, R.
2014-01-01
We present a systematic review of seven threshold models of technological transitions from physics, biology, economics and sociology. The very same phenomenon of a technological transition can be explained by very different logics, ranging from economic explanations based on price, performance and
Vacuum transitions in dual models
International Nuclear Information System (INIS)
Pashnev, A.I.; Volkov, D.V.; Zheltukhin, A.A.
1976-01-01
The investigation is continued of the spontaneous vacuum transition problem in the Neview-Schwartz dual model (NSDM). It is shown that vacuum transitions allow disclosing of supplementary degeneration in the resonance state spectrum. The dual amplitudes possess an internal structure corresponding to the presence of an infinite number of quarks with increasing masses and retained charges. The Adler principle holds. Analytic continuation on the constant of induced vacuum transitions makes it possible to establish the existence of spontaneous vacuum transitions in the NSDM. The consequence of this fact is the exact SU(2) symmetry of π, rho meson trajectories and the Higgs mechanism in the model. In this case the ratios of masses of particles leading trajectories are analogous to those obtained in the current algebra. It is shown that in the NSDM there arises chiral SU(2) x SU(2) x U(1) x U(1) x ... symmetry resulting from spontaneous vacuum transitions
Numerical Modeling of Micro Fluidics of Polymer Melts
DEFF Research Database (Denmark)
Marin, José Manuel Román; Rasmussen, Henrik K.
2008-01-01
A new Galerkin finite element scheme for the numerical simulation of three-dimensional time-dependent flow of K-BKZ fluids has been developed. The scheme was used to model the polymer melt flow in nano imprint lithography (NIL). In NIL a sub micrometer pattern is hot pressed onto a thin polymer...... film on a hard substrate. The numerical method is based on a Lagrangian kinematics description of the fluid, where the (Cartesian) coordinate system attached to the particles is discretized by ten-node quadratic tetrahedral elements. The time integral in the K-BKZ model is discretized by a quadratic...
Heat transfer modelling and stability analysis of selective laser melting
International Nuclear Information System (INIS)
Gusarov, A.V.; Yadroitsev, I.; Bertrand, Ph.; Smurov, I.
2007-01-01
The process of direct manufacturing by selective laser melting basically consists of laser beam scanning over a thin powder layer deposited on a dense substrate. Complete remelting of the powder in the scanned zone and its good adhesion to the substrate ensure obtaining functional parts with improved mechanical properties. Experiments with single-line scanning indicate, that an interval of scanning velocities exists where the remelted tracks are uniform. The tracks become broken if the scanning velocity is outside this interval. This is extremely undesirable and referred to as the 'balling' effect. A numerical model of coupled radiation and heat transfer is proposed to analyse the observed instability. The 'balling' effect at high scanning velocities (above ∼20 cm/s for the present conditions) can be explained by the Plateau-Rayleigh capillary instability of the melt pool. Two factors stabilize the process with decreasing the scanning velocity: reducing the length-to-width ratio of the melt pool and increasing the width of its contact with the substrate
Sen Gupta, A.; Tarboton, D. G.; Racoviteanu, A.; Brown, M. E.; Habib, S.
2014-12-01
This study enhances an energy balance snowmelt model (Utah Energy Balance, UEB) to include the capability to quantify glacier melt. To account for clean and debris covered glaciers, substrate albedo and glacier outlines determined from remote sensing, are taken as inputs. The model uses the surface energy balance to compute the melting of seasonal snow and glacier substrate once the seasonal snow has melted. In this application the model was run over a 360 km2 glacierized watershed, Langtang Khola, in the Nepal Himalaya for a 10-year simulation period starting in water year 2003. The model was run on a distributed mesh of grid cells providing the capability to quantify both timing and spatial variability in snow and glacier melt. The distributed UEB melt model has a relatively high data demand, while the Hindu-Kush Himalayan region is a data-scarce region, a limitation that affects most water resources impact studies in this region. In this study, we determined model inputs from the Modern Era Retrospective-Analysis for Research and Applications (MERRA) and Southern Asia Daily Rainfall Estimate (RFE2) data products. The model estimates that roughly 57% of total surface water input is generated from glacier melt, while snowmelt and rain contribute 34% and 9%, respectively over the simulation period. The melt model provided input to the USGS Geospatial Stream Flow Model (GeoSFM) for the computation of streamflow and produced reasonable streamflow simulations at daily scale with some discrepancies, while monthly and annual scale comparisons resulted in better agreement. The result suggests that this approach is of interest for water resources applications where monthly or longer scale streamflow estimates are needed. Mean annual streamflow was positively correlated with the total annual surface water input. However, mean annual streamflow was not correlated with total annual precipitation, highlighting the importance of energy balance melt calculation, in comparison
Czech Academy of Sciences Publication Activity Database
Yoshikawa, A.; Jouini, A.; Kamada, K.; Boulon, G.; Nikl, Martin; Saito, F.
2009-01-01
Roč. 129, č. 12 (2009), s. 1646-1650 ISSN 0022-2313 R&D Projects: GA AV ČR KAN300100802; GA MŠk ME 953 Institutional research plan: CEZ:AV0Z10100521 Keywords : phase transition * growth from melt * fluoride * luminescent materials Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.847, year: 2009
Scrap melting model for steel converter founded on interfacial solid/liquid phenomena
Kruskopf, Ari; Holappa, Lauri
2017-12-01
The primary goal in steel converter operation is the removal of carbon from the hot metal. This is achieved by blowing oxygen into the melt. The oxidation of carbon produces a lot of heat. To avoid too high temperatures in the melt cold scrap (recycled steel) is charged into the converter. The melting rate is affected by heat and carbon mass transfer. A process model for steel converter is in development. This model is divided into several modules, which are fluid dynamics, heat- and mass-transfer, scrap melting and chemical reactions. This article focuses on the development of the scrap melting module. A numerical model for calculating temperature and carbon concentration in the melt is presented. The melt model is connected with the solid scrap model via solid/liquid interface. The interface model can take into account solidification of iron melt, melting of solidified layer, a situation without such phase changes, and scrap melting. The aim is to predict the melting rate of the scrap including the properties of the hot metal. The model is tested by calculating the melting rates for different scrap thicknesses. All of the stages in the interface model were taking place in the test calculations.
An analogue model of melt segregation and accumulation processes in the Earth’s crust
Directory of Open Access Journals (Sweden)
Soesoo, Alvar
2007-03-01
Full Text Available An analogue experiment was carried out to model melt segregation from the solid rock matrix and its subsequent transport. Carbon dioxide gas and sand were used as analogue materials of crustal partial melt and host rock, respectively. The analogue model displays the diffusional transport mode at low flux rates and the transition to the ballistical mode as the response of the system to a higher gas flux. The ballistical mode is characterized by discontinuous transport and extraction of the gas phase in separate batches, which leads to the development of power law batch size distribution in the system. The gas is extracted preferentially in large batches and does not influence the state of the system and size distribution of remaining batches. The implications of the analogue model to real magmatic processes are supported by power law leucosome width distributions measured in several migmatite localities. The emergence of fractality and 1/f power spectrum of system fluctuations provide evidence of possible self-organized critical nature of melt segregation processes.
Modeling Plume-Triggered, Melt-Enabled Lithospheric Delamination
Perry-Houts, J.; Humphreys, G.
2015-12-01
It has been suggested that arrival of the Yellowstone plume below North America triggered a lithospheric foundering event which aided the eruption of the Columbia River flood basalts. This hypothesis potentially accounts for some of the biggest mysteries related to the CRB's including their location as "off-track" plume volcanism; and the anomalous chemical signatures of the most voluminous units. The foundered lithosphere appears to be a remnant chunk of Farallon slab, which had been stranded beneath the Blue Mountains terrain since the accretion of Siletzia. If this is the case then the mechanisms by which this slab stayed metastable between Siletzia accretion and CRB time, and then so suddenly broke loose, is unclear. The addition of heat and mantle buoyancy supplied by the Yellowstone plume provides a clue, but the geodynamic process by which the slab was able to detach remains unclear.Efforts to model numerically the underlying processes behind delamination events have been gaining popularity. Typically, such models have relied on drastically weakened regions within the crust, or highly non-linear rheologies to enable initiation and propagation of lithosphere removal. Rather than impose such a weak region a priori, we investigated the role of mantle and crustal melt, generated by the addition of plume heat, as the source of such a rheologic boundary.We track melt generation and migration though geodynamic models using the Eulerian finite element code, ASPECT. Melt moves relative to the permeable, compacting, and viscously-deforming mantle using the approach of (Keller, et al. 2013) with the notable exception that ASPECT currently cannot model elasticity. Dike and sill emplacement is therefore still a work in progress. This work is still in the preliminary stages and results are yet inconclusive.
Transition Models with Measurement Errors
Magnac, Thierry; Visser, Michael
1999-01-01
In this paper, we estimate a transition model that allows for measurement errors in the data. The measurement errors arise because the survey design is partly retrospective, so that individuals sometimes forget or misclassify their past labor market transitions. The observed data are adjusted for errors via a measurement-error mechanism. The parameters of the distribution of the true data, and those of the measurement-error mechanism are estimated by a two-stage method. The results, based on ...
DEFF Research Database (Denmark)
Nielsen, Jens Kromann; Hassager, Ole; Rasmussen, Henrik K.
2009-01-01
Leish model. The relaxation modulus G(t,) is measured using stress relaxation after a sudden shearing displacement and we experimentally determine the Rouse time R by observing strain-time separability G(t,)=G(t)h() for t>R. The transient elongational properties are measured using three distinct instruments......–Edwards reptation model for Deborah numbers based on the Rouse time less than about DeR=0.04. For DeR=0.04, the stress difference follows more or less the Doi–Edwards prediction in the limit of infinite stretch rates and, for DeR>0.04, the measured stresses are well above those that can be predicted by the basic......We measure the viscoelastic properties of a highly entangled narrow molecular weight polyisoprene melt with approximately 280 entanglements per chain in steady and transient shear and in elongational flows. The storage and loss moduli of the melt are found to be well described by the Milner and Mc...
Pre-transition phenomena in CdTe near the melting point
Shcherbak, L.
1999-02-01
The influence of slight (up to 2 mol%) CdTe doping by In or Ge on the post-melting effect in CdTe as well as the correlation between the melt's superheating and supercooling has been studied by the DTA method. Some additional endothermic effects above the melting point or liquidus temperature were observed in all the investigated melts. A high degree of structural ordering both in the pure and doped melts was concluded. The structure of the molten state is determined by the thermal pre-history of the solid one. The possibility of a high-temperature CdTe polymorphic modification is discussed.
Thermal Modeling of Direct Digital Melt-Deposition Processes
Cooper, K. P.; Lambrakos, S. G.
2011-02-01
Additive manufacturing involves creating three-dimensional (3D) objects by depositing materials layer-by-layer. The freeform nature of the method permits the production of components with complex geometry. Deposition processes provide one more capability, which is the addition of multiple materials in a discrete manner to create "heterogeneous" objects with locally controlled composition and microstructure. The result is direct digital manufacturing (DDM) by which dissimilar materials are added voxel-by-voxel (a voxel is volumetric pixel) following a predetermined tool-path. A typical example is functionally gradient material such as a gear with a tough core and a wear-resistant surface. The inherent complexity of DDM processes is such that process modeling based on direct physics-based theory is difficult, especially due to a lack of temperature-dependent thermophysical properties and particularly when dealing with melt-deposition processes. In order to overcome this difficulty, an inverse problem approach is proposed for the development of thermal models that can represent multi-material, direct digital melt deposition. This approach is based on the construction of a numerical-algorithmic framework for modeling anisotropic diffusivity such as that which would occur during energy deposition within a heterogeneous workpiece. This framework consists of path-weighted integral formulations of heat diffusion according to spatial variations in material composition and requires consideration of parameter sensitivity issues.
Modeling and simulation of Si crystal growth from melt
Energy Technology Data Exchange (ETDEWEB)
Liu, Lijun; Liu, Xin; Li, Zaoyang [National Engineering Research Center for Fluid Machinery and Compressors, School of Energy and Power Engineering, Xi' an Jiaotong University, Xi' an, Shaanxi 710049 (China); Miyazawa, Hiroaki; Nakano, Satoshi; Kakimoto, Koichi [Research Institute for Applied Mechanics, Kyushu University, Kasuga 816-8580 (Japan)
2009-07-01
A numerical simulator was developed with a global model of heat transfer for any crystal growth taking place at high temperature. Convective, conductive and radiative heat transfers in the furnace are solved together in a conjugated way by a finite volume method. A three-dimensional (3D) global model was especially developed for simulation of heat transfer in any crystal growth with 3D features. The model enables 3D global simulation be conducted with moderate requirement of computer resources. The application of this numerical simulator to a CZ growth and a directional solidification process for Si crystals, the two major production methods for crystalline Si for solar cells, was introduced. Some typical results were presented, showing the importance and effectiveness of numerical simulation in analyzing and improving these kinds of Si crystal growth processes from melt. (copyright 2009 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)
Naumis, Gerardo G
2012-06-01
When a liquid melt is cooled, a glass or phase transition can be obtained depending on the cooling rate. Yet, this behavior has not been clearly captured in energy-landscape models. Here, a model is provided in which two key ingredients are considered in the landscape, metastable states and their multiplicity. Metastable states are considered as in two level system models. However, their multiplicity and topology allows a phase transition in the thermodynamic limit for slow cooling, while a transition to the glass is obtained for fast cooling. By solving the corresponding master equation, the minimal speed of cooling required to produce the glass is obtained as a function of the distribution of metastable states.
A foam melting model for lost foam casting of aluminum
Energy Technology Data Exchange (ETDEWEB)
Caulk, D.A. [Manufacturing Systems Research Laboratory, General Motors Research and Development Center, 30500 Mound Road, Warren, MI 48090-9055 (United States)
2006-07-15
In lost foam casting of aluminum the liquid metal normally decomposes the foam pattern by ablation. But sometimes polymer vapor bubbling through the liquid metal accumulates along an upward-facing flow front until it opens a finite gap between the liquid metal and the decomposing foam. This changes the foam decomposition mechanism along that front from direct ablation to melting. A mathematical model is formulated for heat conduction, convection, and radiation across the gap, coupled with the vaporization of the excess polymer liquid behind the metal front and the resulting buoyant movement of polymer vapor bubbles through the liquid metal. Both models are combined to obtain an analytical solution for one-dimensional bottom filling of a pattern with uniform thickness. The results from this solution not only compare well with available experimental data, but they also explain how part thickness, metal temperature, and pressure affect filling speeds in bottom-fill situations. (author)
International Nuclear Information System (INIS)
Bishop, M.; Ceperley, D.; Frisch, H.L.; Kalos, M.H.
1982-01-01
We report additional results on a simple model of polymers, namely the diffusion in concentrated polymer systems and the static properties of one long chain in a dilute melt of shorter chains. It is found, for the polymer sizes and time scales amenable to our computer calculations, that there is as yet no evidence for a ''reptation'' regime in a melt. There is some indication of reptation in the case of a single chain moving through fixed obstacles. No statistically significant effect of the change, from excluded volume behavior of the long chain to ideal behavior as the shorter chains grow, is observed
Simple models for the simulation of submarine melt for a Greenland glacial system model
Beckmann, Johanna; Perrette, Mahé; Ganopolski, Andrey
2018-01-01
Two hundred marine-terminating Greenland outlet glaciers deliver more than half of the annually accumulated ice into the ocean and have played an important role in the Greenland ice sheet mass loss observed since the mid-1990s. Submarine melt may play a crucial role in the mass balance and position of the grounding line of these outlet glaciers. As the ocean warms, it is expected that submarine melt will increase, potentially driving outlet glaciers retreat and contributing to sea level rise. Projections of the future contribution of outlet glaciers to sea level rise are hampered by the necessity to use models with extremely high resolution of the order of a few hundred meters. That requirement in not only demanded when modeling outlet glaciers as a stand alone model but also when coupling them with high-resolution 3-D ocean models. In addition, fjord bathymetry data are mostly missing or inaccurate (errors of several hundreds of meters), which questions the benefit of using computationally expensive 3-D models for future predictions. Here we propose an alternative approach built on the use of a computationally efficient simple model of submarine melt based on turbulent plume theory. We show that such a simple model is in reasonable agreement with several available modeling studies. We performed a suite of experiments to analyze sensitivity of these simple models to model parameters and climate characteristics. We found that the computationally cheap plume model demonstrates qualitatively similar behavior as 3-D general circulation models. To match results of the 3-D models in a quantitative manner, a scaling factor of the order of 1 is needed for the plume models. We applied this approach to model submarine melt for six representative Greenland glaciers and found that the application of a line plume can produce submarine melt compatible with observational data. Our results show that the line plume model is more appropriate than the cone plume model for simulating
Models and correlations of the DEBRIS Late-Phase Melt Progression Model
International Nuclear Information System (INIS)
Schmidt, R.C.; Gasser, R.D.
1997-09-01
The DEBRIS Late Phase Melt Progression Model is an assembly of models, embodied in a computer code, which is designed to treat late-phase melt progression in dry rubble (or debris) regions that can form as a consequence of a severe core uncover accident in a commercial light water nuclear reactor. The approach is fully two-dimensional, and incorporates a porous medium modeling framework together with conservation and constitutive relationships to simulate the time-dependent evolution of such regions as various physical processes act upon the materials. The objective of the code is to accurately model these processes so that the late-phase melt progression that would occur in different hypothetical severe nuclear reactor accidents can be better understood and characterized. In this report the models and correlations incorporated and used within the current version of DEBRIS are described. These include the global conservation equations solved, heat transfer and fission heating models, melting and refreezing models (including material interactions), liquid and solid relocation models, gas flow and pressure field models, and the temperature and compositionally dependent material properties employed. The specific models described here have been used in the experiment design analysis of the Phebus FPT-4 debris-bed fission-product release experiment. An earlier DEBRIS code version was used to analyze the MP-1 and MP-2 late-phase melt progression experiments conducted at Sandia National Laboratories for the US Nuclear Regulatory Commission
Models and correlations of the DEBRIS Late-Phase Melt Progression Model
Energy Technology Data Exchange (ETDEWEB)
Schmidt, R.C.; Gasser, R.D. [Sandia National Labs., Albuquerque, NM (United States). Reactor Safety Experiments Dept.
1997-09-01
The DEBRIS Late Phase Melt Progression Model is an assembly of models, embodied in a computer code, which is designed to treat late-phase melt progression in dry rubble (or debris) regions that can form as a consequence of a severe core uncover accident in a commercial light water nuclear reactor. The approach is fully two-dimensional, and incorporates a porous medium modeling framework together with conservation and constitutive relationships to simulate the time-dependent evolution of such regions as various physical processes act upon the materials. The objective of the code is to accurately model these processes so that the late-phase melt progression that would occur in different hypothetical severe nuclear reactor accidents can be better understood and characterized. In this report the models and correlations incorporated and used within the current version of DEBRIS are described. These include the global conservation equations solved, heat transfer and fission heating models, melting and refreezing models (including material interactions), liquid and solid relocation models, gas flow and pressure field models, and the temperature and compositionally dependent material properties employed. The specific models described here have been used in the experiment design analysis of the Phebus FPT-4 debris-bed fission-product release experiment. An earlier DEBRIS code version was used to analyze the MP-1 and MP-2 late-phase melt progression experiments conducted at Sandia National Laboratories for the US Nuclear Regulatory Commission.
International Nuclear Information System (INIS)
Daoulas, Kostas Ch; Rühle, Victor; Kremer, Kurt
2012-01-01
We develop a hybrid Monte Carlo approach for modelling nematic liquid crystals of homopolymer melts. The polymer architecture is described with a discrete worm-like chain model. A quadratic density functional accounts for the limited compressibility of the liquid, while an additional quadratic functional of the local orientation tensor of the segments captures the nematic ordering. The approach can efficiently address large systems parametrized according to volumetric and conformational properties, representative of real polymeric materials. The results of the simulations regarding the influence of the molecular weight on the isotropic-nematic transition are compared to predictions from a Landau-de Gennes free energy expansion. The formation of the nematic phase is addressed within Rouse-like dynamics, realized using the current model. (paper)
Model and simulation for melt flow in micro-injection molding based on the PTT model
International Nuclear Information System (INIS)
Cao, Wei; Kong, Lingchao; Li, Qian; Ying, Jin; Shen, Changyu
2011-01-01
Unsteady viscoelastic flows were studied using the finite element method in this work. The Phan-Thien–Tanner (PTT) model was used to represent the rheological behavior of viscoelastic fluids. To effectively describe the microscale effects, the slip boundary condition and surface tension were added to the mathematical model for melt flow in micro-injection molding. The new variational equation of pressure, including the viscoelastic parameters and slip boundary condition, was generalized using integration by parts. A computer code based on the finite element method and finite difference method was developed to solve the melt flow problem. Numerical simulation revealed that the melt viscoelasticity plays an important role in the prediction of melt pressure, temperature at the gate and the succeeding melt front advancement in the cavity. Using the viscoelastic model one can also control the rapid increase in simulated pressure, temperature, and reduce the filling difference among different cavities. The short shot experiments of micro-motor shaft showed that the predicted melt front from the viscoelastic model is in fair agreement with the corresponding experimental results
Zhang, Yanfei; Wang, Chao; Jin, Zhenmin; Zhu, Lüyun
2017-11-01
Widespread low velocity anomalies have been observed in the upper mantle around many oceanic subduction zones. Fluid or melt released from a stagnant slab may have contributed to the formation of these anomalies. Furthermore, slab partial melting or dehydration is also thought to be closely related to the origin of intraplate volcanoes (i.e., Changbaishan). However, experimental evidence on the process of slab partial melting is very limited. Here, our experimental results show that partial melting of stagnant oceanic lithosphere may occurs for temperatures above 1300-1400 °C, with residual phases composed of wadsleyite/ringwoodite + garnet + clinopyroxene/stishovite/akimotite. The density of melt was approximately 1.0-1.5 g/cm3 less dense than the surrounding mantle, which provided a buoyancy force for ascent to the upper mantle across the 410-km seismic discontinuity. The ascending melt may react with mantle peridotite, leading to the formation of a variably metasomatized mantle, which may contribute to the formation of the observed low velocity anomalies above stagnant slab. Re-melting of the metasomatized mantle may have contributed to the origin of the intraplate volcanoes, e.g., Changbaishan volcanoes. We suggest that partial melting of stagnant oceanic lithosphere in the MTZ may have close relations with the origin of the big mantle wedge beneath eastern China.
A thermo dynamical model for the shape and size effect on melting of boron carbide nanoparticles.
Antoniammal, Paneerselvam; Arivuoli, Dakshanamoorthy
2012-02-01
The size and shape dependence of the melting temperature of Boron Carbide (B4C) nanoparticles has been investigated with a numerical thermo dynamical approach. The problem considered in this paper is the inward melting of nanoparticles with spherical and cylindrical geometry. The cylindrical Boron Carbide (B4C) nanoparticles, whose melting point has been reported to decrease with decreasing particle radius, become larger than spherical shaped nanoparticle. Comparative investigation of the size dependence of the melting temperature with respect to the two shapes is also been done. The melting temperature obtained in the present study is approximately a dealing function of radius, in a good agreement with prediction of thermo dynamical model.
Phase transition in tensor models
Energy Technology Data Exchange (ETDEWEB)
Delepouve, Thibault [Laboratoire de Physique Théorique, CNRS UMR 8627, Université Paris Sud,91405 Orsay Cedex (France); Centre de Physique Théorique, CNRS UMR 7644, École Polytechnique,91128 Palaiseau Cedex (France); Gurau, Razvan [Centre de Physique Théorique, CNRS UMR 7644, École Polytechnique,91128 Palaiseau Cedex (France); Perimeter Institute for Theoretical Physics,31 Caroline St. N, N2L 2Y5, Waterloo, ON (Canada)
2015-06-25
Generalizing matrix models, tensor models generate dynamical triangulations in any dimension and support a 1/N expansion. Using the intermediate field representation we explicitly rewrite a quartic tensor model as a field theory for a fluctuation field around a vacuum state corresponding to the resummation of the entire leading order in 1/N (a resummation of the melonic family). We then prove that the critical regime in which the continuum limit in the sense of dynamical triangulations is reached is precisely a phase transition in the field theory sense for the fluctuation field.
Yakub, Eugene; Ronchi, Claudio; Staicu, Dragos
2007-09-07
Results of molecular dynamics (MD) simulation of UO2 in a wide temperature range are presented and discussed. A new approach to the calibration of a partly ionic Busing-Ida-type model is proposed. A potential parameter set is obtained reproducing the experimental density of solid UO2 in a wide range of temperatures. A conventional simulation of the high-temperature stoichiometric UO2 on large MD cells, based on a novel fast method of computation of Coulomb forces, reveals characteristic features of a premelting lambda transition at a temperature near to that experimentally observed (T(lambda)=2670 K). A strong deviation from the Arrhenius behavior of the oxygen self-diffusion coefficient was found in the vicinity of the transition point. Predictions for liquid UO2, based on the same potential parameter set, are in good agreement with existing experimental data and theoretical calculations.
Multiphysics modeling of selective laser sintering/melting
Ganeriwala, Rishi Kumar
A significant percentage of total global employment is due to the manufacturing industry. However, manufacturing also accounts for nearly 20% of total energy usage in the United States according to the EIA. In fact, manufacturing accounted for 90% of industrial energy consumption and 84% of industry carbon dioxide emissions in 2002. Clearly, advances in manufacturing technology and efficiency are necessary to curb emissions and help society as a whole. Additive manufacturing (AM) refers to a relatively recent group of manufacturing technologies whereby one can 3D print parts, which has the potential to significantly reduce waste, reconfigure the supply chain, and generally disrupt the whole manufacturing industry. Selective laser sintering/melting (SLS/SLM) is one type of AM technology with the distinct advantage of being able to 3D print metals and rapidly produce net shape parts with complicated geometries. In SLS/SLM parts are built up layer-by-layer out of powder particles, which are selectively sintered/melted via a laser. However, in order to produce defect-free parts of sufficient strength, the process parameters (laser power, scan speed, layer thickness, powder size, etc.) must be carefully optimized. Obviously, these process parameters will vary depending on material, part geometry, and desired final part characteristics. Running experiments to optimize these parameters is costly, energy intensive, and extremely material specific. Thus a computational model of this process would be highly valuable. In this work a three dimensional, reduced order, coupled discrete element - finite difference model is presented for simulating the deposition and subsequent laser heating of a layer of powder particles sitting on top of a substrate. Validation is provided and parameter studies are conducted showing the ability of this model to help determine appropriate process parameters and an optimal powder size distribution for a given material. Next, thermal stresses upon
Computationally efficient thermal-mechanical modelling of selective laser melting
Yang, Yabin; Ayas, Can
2017-10-01
The Selective laser melting (SLM) is a powder based additive manufacturing (AM) method to produce high density metal parts with complex topology. However, part distortions and accompanying residual stresses deteriorates the mechanical reliability of SLM products. Modelling of the SLM process is anticipated to be instrumental for understanding and predicting the development of residual stress field during the build process. However, SLM process modelling requires determination of the heat transients within the part being built which is coupled to a mechanical boundary value problem to calculate displacement and residual stress fields. Thermal models associated with SLM are typically complex and computationally demanding. In this paper, we present a simple semi-analytical thermal-mechanical model, developed for SLM that represents the effect of laser scanning vectors with line heat sources. The temperature field within the part being build is attained by superposition of temperature field associated with line heat sources in a semi-infinite medium and a complimentary temperature field which accounts for the actual boundary conditions. An analytical solution of a line heat source in a semi-infinite medium is first described followed by the numerical procedure used for finding the complimentary temperature field. This analytical description of the line heat sources is able to capture the steep temperature gradients in the vicinity of the laser spot which is typically tens of micrometers. In turn, semi-analytical thermal model allows for having a relatively coarse discretisation of the complimentary temperature field. The temperature history determined is used to calculate the thermal strain induced on the SLM part. Finally, a mechanical model governed by elastic-plastic constitutive rule having isotropic hardening is used to predict the residual stresses.
Energy Technology Data Exchange (ETDEWEB)
Dmowski, W.; Gierlotka, S.; Wang, Z.; Yokoyama, Y.; Palosz, B.; Egami, T.
2017-07-26
Through high-energy x-ray diffraction and atomic pair density function analysis we find that Zr-based metallic alloy, heated to the supercooled liquid state under hydrostatic pressure and then quenched to room temperature, exhibits a distinct glassy structure. The PDF indicates that the Zr-Zr distances in this glass are significantly reduced compared to those quenched without pressure. Annealing at the glass transition temperature at ambient pressure reverses structural changes and the initial glassy state is recovered. This result suggests that pressure causes a liquid-to-liquid phase transition in this metallic alloy supercooled melt. Such a pressure induced transition is known for covalent liquids, but has not been observed for metallic liquids. The High Pressure Quenched glasses are stable in ambient conditions after decompression.
Modeling the impact of melt on seismic properties during mountain building
Lee, Amicia L.; Walker, Andrew M.; Lloyd, Geoffrey E.; Torvela, Taija
2017-03-01
Initiation of partial melting in the mid/lower crust causes a decrease in P wave and S wave velocities; recent studies imply that the relationship between these velocities and melt is not simple. We have developed a modeling approach to assess the combined impact of various melt and solid phase properties on seismic velocities and anisotropy. The modeling is based on crystallographic preferred orientation (CPO) data measured from migmatite samples, allowing quantification of the variation of seismic velocities with varying melt volumes, shapes, orientations, and matrix anisotropy. The results show nonlinear behavior of seismic properties as a result of the interaction of all of these physical properties, which in turn depend on lithology, stress regime, strain rate, preexisting rock fabrics, and pressure-temperature conditions. This nonlinear behavior is evident when applied to a suite of samples from a traverse across a migmatitic shear zone in the Seiland Igneous Province, Northern Norway. Critically, changes in solid phase composition and CPO, and melt shape and orientation with respect to the wave propagation direction can result in huge variations in the same seismic property even if the melt fraction remains the same. A comparison with surface wave interpretations from tectonically active regions highlights the issues in current models used to predict melt percentages or partially molten regions. Interpretation of seismic data to infer melt percentages or extent of melting should, therefore, always be underpinned by robust modeling of the underlying geological parameters combined with examination of multiple seismic properties in order to reduce uncertainty of the interpretation.
Ex-Vessel Core Melt Modeling Comparison between MELTSPREAD-CORQUENCH and MELCOR 2.1
Energy Technology Data Exchange (ETDEWEB)
Robb, Kevin R. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Farmer, Mitchell [Argonne National Lab. (ANL), Argonne, IL (United States); Francis, Matthew W. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)
2014-03-01
System-level code analyses by both United States and international researchers predict major core melting, bottom head failure, and corium-concrete interaction for Fukushima Daiichi Unit 1 (1F1). Although system codes such as MELCOR and MAAP are capable of capturing a wide range of accident phenomena, they currently do not contain detailed models for evaluating some ex-vessel core melt behavior. However, specialized codes containing more detailed modeling are available for melt spreading such as MELTSPREAD as well as long-term molten corium-concrete interaction (MCCI) and debris coolability such as CORQUENCH. In a preceding study, Enhanced Ex-Vessel Analysis for Fukushima Daiichi Unit 1: Melt Spreading and Core-Concrete Interaction Analyses with MELTSPREAD and CORQUENCH, the MELTSPREAD-CORQUENCH codes predicted the 1F1 core melt readily cooled in contrast to predictions by MELCOR. The user community has taken notice and is in the process of updating their systems codes; specifically MAAP and MELCOR, to improve and reduce conservatism in their ex-vessel core melt models. This report investigates why the MELCOR v2.1 code, compared to the MELTSPREAD and CORQUENCH 3.03 codes, yield differing predictions of ex-vessel melt progression. To accomplish this, the differences in the treatment of the ex-vessel melt with respect to melt spreading and long-term coolability are examined. The differences in modeling approaches are summarized, and a comparison of example code predictions is provided.
Energy Technology Data Exchange (ETDEWEB)
McHugh, P.R.; Ramshaw, J.D.
1991-11-01
MAGMA is a FORTRAN computer code designed to viscous flow in in situ vitrification melt pools. It models three-dimensional, incompressible, viscous flow and heat transfer. The momentum equation is coupled to the temperature field through the buoyancy force terms arising from the Boussinesq approximation. All fluid properties, except density, are assumed variable. Density is assumed constant except in the buoyancy force terms in the momentum equation. A simple melting model based on the enthalpy method allows the study of the melt front progression and latent heat effects. An indirect addressing scheme used in the numerical solution of the momentum equation voids unnecessary calculations in cells devoid of liquid. Two-dimensional calculations can be performed using either rectangular or cylindrical coordinates, while three-dimensional calculations use rectangular coordinates. All derivatives are approximated by finite differences. The incompressible Navier-Stokes equations are solved using a new fully implicit iterative technique, while the energy equation is differenced explicitly in time. Spatial derivatives are written in conservative form using a uniform, rectangular, staggered mesh based on the marker and cell placement of variables. Convective terms are differenced using a weighted average of centered and donor cell differencing to ensure numerical stability. Complete descriptions of MAGMA governing equations, numerics, code structure, and code verification are provided. 14 refs.
International Nuclear Information System (INIS)
McHugh, P.R.; Ramshaw, J.D.
1991-11-01
MAGMA is a FORTRAN computer code designed to viscous flow in in situ vitrification melt pools. It models three-dimensional, incompressible, viscous flow and heat transfer. The momentum equation is coupled to the temperature field through the buoyancy force terms arising from the Boussinesq approximation. All fluid properties, except density, are assumed variable. Density is assumed constant except in the buoyancy force terms in the momentum equation. A simple melting model based on the enthalpy method allows the study of the melt front progression and latent heat effects. An indirect addressing scheme used in the numerical solution of the momentum equation voids unnecessary calculations in cells devoid of liquid. Two-dimensional calculations can be performed using either rectangular or cylindrical coordinates, while three-dimensional calculations use rectangular coordinates. All derivatives are approximated by finite differences. The incompressible Navier-Stokes equations are solved using a new fully implicit iterative technique, while the energy equation is differenced explicitly in time. Spatial derivatives are written in conservative form using a uniform, rectangular, staggered mesh based on the marker and cell placement of variables. Convective terms are differenced using a weighted average of centered and donor cell differencing to ensure numerical stability. Complete descriptions of MAGMA governing equations, numerics, code structure, and code verification are provided. 14 refs
Mathematical modeling of quartz particle melting process in plasma-chemical reactor
Energy Technology Data Exchange (ETDEWEB)
Volokitin, Oleg, E-mail: volokitin-oleg@mail.ru; Volokitin, Gennady, E-mail: vgg-tomsk@mail.ru; Skripnikova, Nelli, E-mail: nks2003@mai.ru; Shekhovtsov, Valentin, E-mail: shehovcov2010@yandex.ru [Tomsk State University of Architecture and Building, 2, Solyanaya Sq., 634003, Tomsk (Russian Federation); Vlasov, Viktor, E-mail: rector@tsuab.ru [Tomsk State University of Architecture and Building, 2, Solyanaya Sq., 634003, Tomsk (Russian Federation); National Research Tomsk Polytechnic University, 30, Lenin Ave., 634050, Tomsk (Russian Federation)
2016-01-15
Among silica-based materials vitreous silica has a special place. The paper presents the melting process of a quartz particle under conditions of low-temperature plasma. A mathematical model is designed for stages of melting in the experimental plasma-chemical reactor. As calculation data show, quartz particles having the radius of 0.21≤ r{sub p} ≤0.64 mm completely melt at W = 0.65 l/s particle feed rate depending on the Nusselt number, while 0.14≤ r{sub p} ≤0.44 mm particles melt at W = 1.4 l/s. Calculation data showed that 2 mm and 0.4 mm quartz particles completely melted during and 0.1 s respectively. Thus, phase transformations occurred in silicon dioxide play the important part in its heating up to the melting temperature.
Two phase modeling of nanofluid flow in existence of melting heat transfer by means of HAM
Sheikholeslami, M.; Jafaryar, M.; Bateni, K.; Ganji, D. D.
2018-02-01
In this article, Buongiorno Model is applied for investigation of nanofluid flow over a stretching plate in existence of magnetic field. Radiation and Melting heat transfer are taken into account. Homotopy analysis method (HAM) is selected to solve ODEs which are obtained from similarity transformation. Roles of Brownian motion, thermophoretic parameter, Hartmann number, porosity parameter, Melting parameter and Eckert number are presented graphically. Results indicate that nanofluid velocity and concentration enhance with rise of melting parameter. Nusselt number reduces with increase of porosity and melting parameters.
Modelling societal transitions with agent transformation
M.P. Schilperoord (Michel); J. Rotmans (Jan); N. Bergman (Noam)
2008-01-01
textabstractTransition models explain long-term and large-scale processes fundamentally changing the structure of a societal system. Our concern is that most transition models are too static. Although they capture a move of focus from static equilibria to transitions between dynamic equilibria, they
Simple models for the simulation of submarine melt for a Greenland glacial system model
Directory of Open Access Journals (Sweden)
J. Beckmann
2018-01-01
Full Text Available Two hundred marine-terminating Greenland outlet glaciers deliver more than half of the annually accumulated ice into the ocean and have played an important role in the Greenland ice sheet mass loss observed since the mid-1990s. Submarine melt may play a crucial role in the mass balance and position of the grounding line of these outlet glaciers. As the ocean warms, it is expected that submarine melt will increase, potentially driving outlet glaciers retreat and contributing to sea level rise. Projections of the future contribution of outlet glaciers to sea level rise are hampered by the necessity to use models with extremely high resolution of the order of a few hundred meters. That requirement in not only demanded when modeling outlet glaciers as a stand alone model but also when coupling them with high-resolution 3-D ocean models. In addition, fjord bathymetry data are mostly missing or inaccurate (errors of several hundreds of meters, which questions the benefit of using computationally expensive 3-D models for future predictions. Here we propose an alternative approach built on the use of a computationally efficient simple model of submarine melt based on turbulent plume theory. We show that such a simple model is in reasonable agreement with several available modeling studies. We performed a suite of experiments to analyze sensitivity of these simple models to model parameters and climate characteristics. We found that the computationally cheap plume model demonstrates qualitatively similar behavior as 3-D general circulation models. To match results of the 3-D models in a quantitative manner, a scaling factor of the order of 1 is needed for the plume models. We applied this approach to model submarine melt for six representative Greenland glaciers and found that the application of a line plume can produce submarine melt compatible with observational data. Our results show that the line plume model is more appropriate than the cone plume
Toward a coherent model for the melting behavior of the deep Earth's mantle
Andrault, D.; Bolfan-Casanova, N.; Bouhifd, M. A.; Boujibar, A.; Garbarino, G.; Manthilake, G.; Mezouar, M.; Monteux, J.; Parisiades, P.; Pesce, G.
2017-04-01
Knowledge of melting properties is critical to predict the nature and the fate of melts produced in the deep mantle. Early in the Earth's history, melting properties controlled the magma ocean crystallization, which potentially induced chemical segregation in distinct reservoirs. Today, partial melting most probably occurs in the lowermost mantle as well as at mid upper-mantle depths, which control important aspects of mantle dynamics, including some types of volcanism. Unfortunately, despite major experimental and theoretical efforts, major controversies remain about several aspects of mantle melting. For example, the liquidus of the mantle was reported (for peridotitic or chondritic-type composition) with a temperature difference of ∼1000 K at high mantle depths. Also, the Fe partitioning coefficient (DFeBg/melt) between bridgmanite (Bg, the major lower mantle mineral) and a melt was reported between ∼0.1 and ∼0.5, for a mantle depth of ∼2000 km. Until now, these uncertainties had prevented the construction of a coherent picture of the melting behavior of the deep mantle. In this article, we perform a critical review of previous works and develop a coherent, semi-quantitative, model. We first address the melting curve of Bg with the help of original experimental measurements, which yields a constraint on the volume change upon melting (ΔVm). Secondly, we apply a basic thermodynamical approach to discuss the melting behavior of mineralogical assemblages made of fractions of Bg, CaSiO3-perovskite and (Mg,Fe)O-ferropericlase. Our analysis yields quantitative constraints on the SiO2-content in the pseudo-eutectic melt and the degree of partial melting (F) as a function of pressure, temperature and mantle composition; For examples, we find that F could be more than 40% at the solidus temperature, except if the presence of volatile elements induces incipient melting. We then discuss the melt buoyancy in a partial molten lower mantle as a function of pressure
A model for foam formation, stability, and breakdown in glass-melting furnaces
Schaaf, J. van der; Beerkens, R.G.C.
2006-01-01
A dynamic model for describing the build-up and breakdown of a glass-melt foam is presented. The foam height is determined by the gas flux to the glass-melt surface and the drainage rate of the liquid lamellae between the gas bubbles. The drainage rate is determined by the average gas bubble radius
Heat transfer model and finite element formulation for simulation of selective laser melting
Roy, Souvik; Juha, Mario; Shephard, Mark S.; Maniatty, Antoinette M.
2017-10-01
A novel approach and finite element formulation for modeling the melting, consolidation, and re-solidification process that occurs in selective laser melting additive manufacturing is presented. Two state variables are introduced to track the phase (melt/solid) and the degree of consolidation (powder/fully dense). The effect of the consolidation on the absorption of the laser energy into the material as it transforms from a porous powder to a dense melt is considered. A Lagrangian finite element formulation, which solves the governing equations on the unconsolidated reference configuration is derived, which naturally considers the effect of the changing geometry as the powder melts without needing to update the simulation domain. The finite element model is implemented into a general-purpose parallel finite element solver. Results are presented comparing to experimental results in the literature for a single laser track with good agreement. Predictions for a spiral laser pattern are also shown.
Melt pool modelling, simulation and experimental validation for SLM
Wits, Wessel
2017-01-01
SLM parts are built by successively melting layers of powder in a powder bed. Process parameters are often optimized experimentally by laser scanning a number of single tracks and subsequently determining which settings lead to a good compromise between quality and build speed. However,
Energy Technology Data Exchange (ETDEWEB)
Dinh, T.N.; Bui, V.A.; Nourgaliev, R.R. [Royal Institute of Technology, Stockholm (Sweden)] [and others
1995-09-01
The objective of the paper is to study heat and mass transfer processes related to core melt discharge from a reactor vessel is a severe light water reactor accident. The phenomenology of the issue includes (1) melt convection in and heat transfer from the melt pool in contact with the vessel lower head wall; (2) fluid dynamics and heat transfer of the melt flow in the growing discharge hole; and (3) multi-dimensional heat conduction in the ablating lower head wall. A program of model development, validation and application is underway (i) to analyse the dominant physical mechanisms determining characteristics of the lower head ablation process; (ii) to develop and validate efficient analytic/computational methods for estimating heat and mass transfer under phase-change conditions in irregular moving-boundary domains; and (iii) to investigate numerically the melt discharge phenomena in a reactor-scale situation, and, in particular, the sensitivity of the melt discharge transient to structural differences and various in-vessel melt progression scenarios. The paper presents recent results of the analysis and model development work supporting the simulant melt-structure interaction experiments.
Two-dimensional model of laser alloying of binary alloy powder with interval of melting temperature
Knyzeva, A. G.; Sharkeev, Yu. P.
2017-10-01
The paper contains two-dimensional model of laser beam melting of powders from binary alloy. The model takes into consideration the melting of alloy in some temperature interval between solidus and liquidus temperatures. The external source corresponds to laser beam with energy density distributed by Gauss law. The source moves along the treated surface according to given trajectory. The model allows investigating the temperature distribution and thickness of powder layer depending on technological parameters.
The transition probabilities of the reciprocity model
Snijders, T.A.B.
1999-01-01
The reciprocity model is a continuous-time Markov chain model used for modeling longitudinal network data. A new explicit expression is derived for its transition probability matrix. This expression can be checked relatively easily. Some properties of the transition probabilities are given, as well
Experimental testing of olivine-melt equilibrium models at high temperatures
Krasheninnikov, S. P.; Sobolev, A. V.; Batanova, V. G.; Kargaltsev, A. A.; Borisov, A. A.
2017-08-01
Data are presented on the equilibrium compositions of olivine and melts in the products of 101 experiments performed at 1300-1600°C, atmospheric pressure, and controlled oxygen fugacity by means of new equipment at the Vernadsky Institute. It was shown that the available models of the olivine-melt equilibrium describe with insufficient adequacy the natural systems at temperatures over 1400°C. The most adequate is the model by Ford et al. (1983). However, this model overestimates systematically the equilibrium temperature with underestimating by 20-40°C at 1450-1600°C. These data point to the need for developing a new, improved quantitative model of the olivine-melt equilibrium for high-temperature magnesian melts, as well as to the possibility of these studies on the basis of the equipment presented.
Bokarev, Valery P.; Krasnikov, Gennady Ya
2018-02-01
Based on the evaluation of the properties of crystals, such as surface energy and its anisotropy, the surface melting temperature, the anisotropy of the work function of the electron, and the anisotropy of adsorption, were shown the advantages of the model of coordination melting (MCM) in calculating the surface properties of crystals. The model of coordination melting makes it possible to calculate with an acceptable accuracy the specific surface energy of the crystals, the anisotropy of the surface energy, the habit of the natural crystals, the temperature of surface melting of the crystal, the anisotropy of the electron work function and the anisotropy of the adhesive properties of single-crystal surfaces. The advantage of our model is the simplicity of evaluating the surface properties of the crystal based on the data given in the reference literature. In this case, there is no need for a complex mathematical tool, which is used in calculations using quantum chemistry or modeling by molecular dynamics.
Crustal melting beneath orogenic plateaus: Insights from 3-D thermo-mechanical modeling
Chen, L.; Song, X.; Gerya, T.; Xu, T.; Chen, Y.
2017-12-01
Mid-crustal melting is widely documented within orogenic plateaus. However, the mechanism for its generation and its role in the evolution of orogenic plateaus remain poorly understood. Here we use 3-D thermo-mechanical models to investigate the physical controls for mid-crustal melting beneath orogenic plateaus and its consequences in plateau evolution. The results demonstrate that: 1) lateral lithospheric strength contrast between two colliding continents facilitates an episodic growth of orogenic plateau and mid-crustal melting; 2) slower convergence favors larger amount of melt; and 3) radioactive heating during crustal thickening plays the primary role in generating mid-crustal melting. Shear heating also plays a positive role in mid-crustal melting, but its role is secondary to radioactive heating. During collisional orogeny, it is the combination of crustal self-heating (radioactive/shear heating) and the contrast in radiogenic element concentration between the upper and lower crust that makes the base of the thickened upper crust favorable for in situ crustal melting at the mid-crust. We also demonstrate that the occurrence of the mid-crustal melting layer postdates the establishment of a broad orogenic plateau, and causes mechanical decoupling between the overlying upper crust and underlying lower crust by dramatically reducing mid-crustal strength. At the later stage, the melt-weakened layer flows outward in a localized channel and manifest its potential role in the marginal dominance of mid-crustal partial melting. Our models provide a self-consistent explanation for the low S-wave velocity zones widespread in the Tibetan middle crust, which are most prominent in the periphery of Tibet.
Shear-induced network-to-network transition in a block copolymer melt
International Nuclear Information System (INIS)
Cochran, Eric W.; Bates, Frank S.
2004-01-01
A tricontinuous (10,3)c network phase is documented in a poly(cyclohexylethylene-b-ethylethylene-b-ethylene) triblock copolymer melt based on small-angle x-ray scattering. Application of shear transforms the self-assembled soft material into a single crystal (10,3)d network while preserving the short-range threefold connector geometry. Long-range topological restructuring reduces the space group symmetry, from Fddd to Pnna, maintaining orthorhombic lattice symmetry. Both phases are stable to long time annealing, indicative of nearly degenerate free energies and prohibitive kinetic barriers
Melting spectral functions of the scalar and vector mesons in a holographic QCD model
International Nuclear Information System (INIS)
Fujita, Mitsutoshi; Kikuchi, Toru; Fukushima, Kenji; Misumi, Tatsuhiro; Murata, Masaki
2010-01-01
We investigate the finite-temperature spectral functions of heavy quarkonia by using the soft-wall anti-de Sitter/QCD model. We discuss the scalar, the pseudoscalar, the vector, and the axial-vector mesons and compare their qualitative features of the melting temperature and growing width. We find that the axial-vector meson melts earlier than the vector meson, while there appears only a slight difference between the scalar and pseudoscalar mesons, which also melt earlier than the vector meson.
Melting transition of an Ising glass driven by a magnetic field
Arrachea, L.; Dalidovich, D.; Dobrosavljević, V.; Rozenberg, M. J.
2004-02-01
The quantum critical behavior of the Ising glass in a magnetic field is investigated. We focus on the spin-glass-to-paramagnet transition of the transverse degrees of freedom in the presence of a finite longitudinal field. We use two complementary techniques, the Landau theory close to the T=0 transition and the exact diagonalization method for finite systems. This allows us to estimate the size of the critical region and characterize various crossover regimes. An unexpectedly small energy scale on the disordered side of the critical line is found, and its possible relevance to experiments on metallic glasses is briefly discussed.
Phase transitions, melting dynamics, and solid-state diffusion in a nano test tube.
Holmberg, Vincent C; Panthani, Matthew G; Korgel, Brian A
2009-10-16
Confined nanoscale geometry greatly influences physical transformations in materials. The electron microscope enables direct visualization of these changes. We examined the evolution of a germanium (Ge) nanowire attached to a gold (Au) nanocrystal as it was heated to 900 degrees C. The application of a carbon shell prevented changes in volume and interfacial area during the heating cycle. Au/Ge eutectic formation was visualized, occurring 15 degrees C below the bulk eutectic temperature. Capillary pressure pushed the melt into the cylindrical neck of the nanowire, and Ge crystallized in the spherical tip of the carbon shell. Solid-state diffusion down the length of the confined Ge nanowire was observed at temperatures above 700 degrees C; Au diffusion was several orders of magnitude slower than in a bulk Ge crystal.
Improved transition models for cepstral trajectories
CSIR Research Space (South Africa)
Badenhorst, J
2012-11-01
Full Text Available is ideal for the investigation of contextual effects on cepstral trajectories. We show that modelling improvements, such as continuity constraints on parameter values and more flexible transition models, systematically improve the robustness of our...
International Nuclear Information System (INIS)
Sumpter, B.G.; Noid, D.W.; Voth, G.A.; Wunderlich, B.
1990-01-01
Molecular dynamics-based computer simulations are presented for the interaction of one and two infrared (IR) laser beams with a model polymer surface. When a single laser beam system is studied over a wide range of intensities, only melting of the polymer, or melting followed by bond dissociation, is observed for up to 100 picoseconds. In contrast, the two-laser simulation results exhibit a marked difference in the energy absorption behavior of the irradiated polymer which, in turn, results in multiple bond dissociations. The results for the one- and two-laser cases studied can be divided into four different classes of physical behavior: (a) the polymer remains in the solid state; (b) the polymer crystal melts; (c) the polymer ablates, but with significant melting (charring); or (d) the polymer ablates with minimal melting. Damage to the model polymer crystal from absorption of energy from either one or two lasers occurs through a mechanism that involves the competition between the absorption of energy and internal energy redistribution. The rate of energy loss from the absorption site(s) relative to the rate of absorption of energy from the radiation field determines rather the polymer melts or ablates (low absorption rates lead to melting or no change and high rates lead to ablation). A sufficiently large rate of energy absorption is only obtainable through the use of two lasers. Two lasers also significantly decrease the total laser intensity required to cause polymer crystal melting. The differences between the one- and two-laser cases are studied by adapting novel signal/subspace techniques to analyze the dynamical changes in the mode spectrum of the polymer as it melts
Flores-Ruiz, H.; Micoulaut, M.
2018-01-01
We investigate the dynamic properties of Ge-Sb-Te phase change melts using first principles molecular dynamics with a special emphasis on the effect of tellurium composition on melt dynamics. From structural models and trajectories established previously [H. Flores-Ruiz et al., Phys. Rev. B 92, 134205 (2015)], we calculate the diffusion coefficients for the different species, the activation energies for diffusion, the Van Hove correlation, and the intermediate scattering functions able to substantiate the dynamics and relaxation behavior of the liquids as a function of temperature and composition that is also compared to experiment whenever possible. We find that the diffusion is mostly Arrhenius-like and that the addition of Ge/Sb atoms leads to a global decrease of the jump probability and to an increase in activated dynamics for diffusion. Relaxation behavior is analyzed and used in order to evaluate the possibility of a fragile to strong transition that is evidenced from the calculated high fragility (M = 129) of Ge2Sb2Te5 at high temperatures.
Light scattering from block copolymer melts near the order-disorder transition
Czech Academy of Sciences Publication Activity Database
Štěpánek, Petr; Lodge, T. P.; Bates, F. S.
1994-01-01
Roč. 2, - (1994), s. 110 ISSN 0009-2347. [Symposium Block Copolymer Dynamics, Chain Dynamics of Block Copolymers: Dynamics near the Ordering Transition. San Diego, 13.03.1994-18.03.1994] R&D Projects: GA AV ČR IA45023 Impact factor: 0.331, year: 1994
International Nuclear Information System (INIS)
Ko, J; Bhullar, S K; Mohtaram, N K; Willerth, S M; Jun, M B G
2014-01-01
Melt electrospinning creates fibrous scaffolds using direct deposition. The main challenge of melt electrospinning is controlling the topography of the scaffolds for tissue engineering applications. Mathematical modeling enables a better understanding of the parameters that determine the topography of scaffolds. The objective of this study is to build two types of mathematical models. First, we modeled the melt electrospinning process by incorporating parameters such as nozzle size, counter electrode distance and applied voltage that influence fiber diameter and scaffold porosity. Our second model describes the accumulation of the extruded microfibers on flat and round surfaces using data from the microfiber modeling. These models were validated through the use of experimentally obtained data. Scanning electron microscopy (SEM) was used to image the scaffolds and the fiber diameters were measured using Quartz-PCI Image Management Systems® in SEM to measure scaffold porosity. (paper)
A simple model for the evolution of melt pond coverage on permeable Arctic sea ice
Popović, Predrag; Abbot, Dorian
2017-05-01
As the melt season progresses, sea ice in the Arctic often becomes permeable enough to allow for nearly complete drainage of meltwater that has collected on the ice surface. Melt ponds that remain after drainage are hydraulically connected to the ocean and correspond to regions of sea ice whose surface is below sea level. We present a simple model for the evolution of melt pond coverage on such permeable sea ice floes in which we allow for spatially varying ice melt rates and assume the whole floe is in hydrostatic balance. The model is represented by two simple ordinary differential equations, where the rate of change of pond coverage depends on the pond coverage. All the physical parameters of the system are summarized by four strengths that control the relative importance of the terms in the equations. The model both fits observations and allows us to understand the behavior of melt ponds in a way that is often not possible with more complex models. Examples of insights we can gain from the model are that (1) the pond growth rate is more sensitive to changes in bare sea ice albedo than changes in pond albedo, (2) ponds grow slower on smoother ice, and (3) ponds respond strongest to freeboard sinking on first-year ice and sidewall melting on multiyear ice. We also show that under a global warming scenario, pond coverage would increase, decreasing the overall ice albedo and leading to ice thinning that is likely comparable to thinning due to direct forcing. Since melt pond coverage is one of the key parameters controlling the albedo of sea ice, understanding the mechanisms that control the distribution of pond coverage will help improve large-scale model parameterizations and sea ice forecasts in a warming climate.
Mathematical modeling of cold cap: Effect of bubbling on melting rate
Energy Technology Data Exchange (ETDEWEB)
Pokorny, Richard; Kruger, Albert A.; Hrma, Pavel R.
2014-12-31
The rate of melting is a primary concern in the vitrification of radioactive wastes because it directly influences the life cycle of nuclear waste cleanup efforts. To increase glass melting performance, experimental and industrial all-electric waste glass melters employ various melt-rate enhancement techniques, the most prominent being the application of bubblers submerged into molten glass. This study investigates various ways in which bubbling affects melting rate in a waste glass melter. Using the recently developed cold cap model, we suggest that forced convection of molten glass, which increases the cold cap bottom temperature, is the main factor. Other effects, such as stirring the feed into molten glass or reducing the insulating effect of foaming, also play a role.
Culture in Transition: A learning model
DEFF Research Database (Denmark)
Baca, Susan
2010-01-01
of spare capacity, desire, focus, and information. By integrating the element of culture, both in the organizational sense and that pertaining to diversity, otherwise overseen aspects of transition are brought into view, with the potential of reducing stress and increasing job satisfaction. The model...... is useful for both management and labor in regulating transition processes, thus making a contribution to industrial relations....
Modeling and simulation of melt-layer erosion during a plasma disruption
International Nuclear Information System (INIS)
Hassanein, A.; Belan, V.; Konkashbaev, I.; Nikandrov, L.; Safronov, V.; Zhitlukhin, A.; Litunovsky, V.
1997-01-01
Metallic plasma-facing components (PFCs) e.g. beryllium and tungsten, will be subjected to severe melting during plasma instabilities such as disruptions, edge-localized modes and high power excursions. Because of the greater thickness of the resulting melt layers relative to that of the surface vaporization, the potential loss of the developing melt-layer can significantly shorten PFC lifetime, severely contaminate the plasma and potentially prevent successful operation of the tokamak reactor. Mechanisms responsible for melt-layer loss during plasma instabilities are being modeled and evaluated. Of particular importance are hydrodynamic instabilities developed in the liquid layer due to various forces such as those from magnetic fields, plasma impact momentum, vapor recoil and surface tension. Another mechanism found to contribute to melt-layer splashing loss is volume bubble boiling, which can result from overheating of the liquid layer. To benchmark these models, several new experiments were designed and performed in different laboratory devices for this work; the SPLASH codes) are generally in good agreement with the experimental results. The effect of in-reactor disruption conditions, which do not exist in simulation experiments, on melt-layer erosion is discussed. (orig.)
A finite volume alternate direction implicit approach to modeling selective laser melting
DEFF Research Database (Denmark)
Hattel, Jesper Henri; Mohanty, Sankhya
2013-01-01
Over the last decade, several studies have attempted to develop thermal models for analyzing the selective laser melting process with a vision to predict thermal stresses, microstructures and resulting mechanical properties of manufactured products. While a holistic model addressing all involved...... is proposed for modeling single-layer and few-layers selective laser melting processes. The ADI technique is implemented and applied for two cases involving constant material properties and non-linear material behavior. The ADI FV method consume less time while having comparable accuracy with respect to 3D...
Phase transition in the hadron gas model
International Nuclear Information System (INIS)
Gorenstein, M.I.; Petrov, V.K.; Zinov'ev, G.M.
1981-01-01
A class of statistical models of hadron gas allowing an analytical solution is considered. A mechanism of a possible phase transition in such a system is found and conditions for its occurence are determined [ru
Geotechnical modeling of high-level nuclear waste disposal by rock melting
International Nuclear Information System (INIS)
Heuze, F.E.
1981-12-01
A new strategy has been developed for the geotechnical modeling of nuclear waste disposal by rock melting (DRM). Three seeparate tasks were performed to reach this objective: a review of the four scenarios which have been proposed for DRM, to date; an evaluation of computer-based numerical models which could be used to analyze the mechanical, thermal, and hydraulic processes involved in DRM; and a critical review of rock mass properties which are relevant to the design and safety of waste disposal by rock melting. It is concluded that several geotechnical aspects of DRM can be studied realistically with current state-of-the-art model capabilities and knowledge of material properties. The next step in the feasibility study of DRM should be a best-estimate calculation of the four cavity-melt and canister-burial concepts. These new analyses will indicate the most critical areas for subsequent research
Panel Smooth Transition Regression Models
DEFF Research Database (Denmark)
González, Andrés; Terasvirta, Timo; Dijk, Dick van
models to the panel context. The strategy consists of model specification based on homogeneity tests, parameter estimation, and model evaluation, including tests of parameter constancy and no remaining heterogeneity. The model is applied to describing firms' investment decisions in the presence...
Verifying the polymer drawing model of melt blowing using factory production data
Directory of Open Access Journals (Sweden)
Wu Li-Li
2015-01-01
Full Text Available Non-woven samples were collected from four non-woven factories. The fiber diameters of the non-woven samples were measured, which agree tally well with the predicted ones by the polymer drawing model. The paper concludes that the model can be effectively applied to the melt blowing technology.
Kawakami, Tetsuo; Yamaguchi, Isao; Miyake, Akira; Shibata, Tomoyuki; Maki, Kenshi; Yokoyama, Takaomi D.; Hirata, Takafumi
2013-01-01
Behavior of zircon at the schist/migmatite transition is investigated. Syn-metamorphic overgrowth is rare in zircon in schists, whereas zircon in migmatites has rims with low Th/U that give 90.3 ± 2.2 Ma U–Pb concordia age. Between inherited core and the metamorphic rim, a thin, dark-CL annulus containing melt inclusion is commonly developed, suggesting that it formed contemporaneous with the rim in the presence of melt. In diatexites, the annulus is further truncated by the brighter-CL overg...
Photoinduced charge-order melting dynamics in a one-dimensional interacting Holstein model
Hashimoto, Hiroshi; Ishihara, Sumio
2017-07-01
Transient quantum dynamics in an interacting fermion-phonon system are investigated with a focus on a charge order (CO) melting after a short optical-pulse irradiation and the roles of the quantum phonons in the transient dynamics. A spinless-fermion model in a one-dimensional chain coupled with local phonons is analyzed numerically. The infinite time-evolving block decimation algorithm is adopted as a reliable numerical method for one-dimensional quantum many-body systems. Numerical results for the photoinduced CO melting dynamics without phonons are well interpreted by the soliton picture for the CO domains. This interpretation is confirmed by numerical simulation of an artificial local excitation and the classical soliton model. In the case of large phonon frequencies corresponding to the antiadiabatic condition, CO melting is induced by propagations of the polaronic solitons with the renormalized soliton velocity. On the other hand, in the case of small phonon frequencies corresponding to the adiabatic condition, the first stage of the CO melting dynamics occurs due to the energy transfer from the fermionic to phononic systems, and the second stage is brought about by the soliton motions around the bottom of the soliton band. The analyses provide a standard reference for photoinduced CO melting dynamics in one-dimensional many-body quantum systems.
Polymerisation, basicity, oxidation state and their role in ionic modelling of silicate melts
Directory of Open Access Journals (Sweden)
R. Moretti
2005-06-01
Full Text Available In order to describe and quantify the reactivity of silicate melts, the ionic notation provided by the Temkin formalism has been historically accepted, giving rise to the study of melt chemical equilibria in terms of completely dissociated ionic species. Indeed, ionic modelling of melts works properly as long as the true extension of the anionic matrix is known. This information may be attained in the framework of the Toop-Samis (1962a,b model, through a parameterisation of the acid-base properties of the dissolved oxides. Moreover, by combining the polymeric model of Toop and Samis with the «group basicity» concept of Duffy and Ingram (1973, 1974a,b, 1976 the bulk optical basicity (Duffy and Ingram, 1971; Duffy, 1992 of molten silicates and glasses can be split into two distinct contributions, i.e. the basicity of the dissolved basic oxides and the basicity of the polymeric units. Application to practical cases, such as the assessment of the oxidation state of iron, require bridging of the energetic gap between the standard state of completely dissociated component (Temkin standard state and the standard state of pure melt component at P and T of interest. On this basis it is possible to set up a preliminary model for iron speciation in both anhydrous and hydrous aluminosilicate melts. In the case of hydrous melts, I introduce both acidic and basic dissociation of the water component, requiring the combined occurrence of H+ cations, OH- free anions and, to a very minor extent, of T-OH groups. The amphoteric behaviour of water revealed by this study is therefore in line with the earlier prediction of Fraser (1975.
The modeling of core melting and in-vessel corium relocation in the APRIL code
Energy Technology Data Exchange (ETDEWEB)
Kim. S.W.; Podowski, M.Z.; Lahey, R.T. [Rensselaer Polytechnic Institute, Troy, NY (United States)] [and others
1995-09-01
This paper is concerned with the modeling of severe accident phenomena in boiling water reactors (BWR). New models of core melting and in-vessel corium debris relocation are presented, developed for implementation in the APRIL computer code. The results of model testing and validations are given, including comparisons against available experimental data and parametric/sensitivity studies. Also, the application of these models, as parts of the APRIL code, is presented to simulate accident progression in a typical BWR reactor.
Optimization models in a transition economy
Sergienko, Ivan V; Koshlai, Ludmilla
2014-01-01
This book opens new avenues in understanding mathematical models within the context of a transition economy. The exposition lays out the methods for combining different mathematical structures and tools to effectively build the next model that will accurately reflect real world economic processes. Mathematical modeling of weather phenomena allows us to forecast certain essential weather parameters without any possibility of changing them. By contrast, modeling of transition economies gives us the freedom to not only predict changes in important indexes of all types of economies, but also to influence them more effectively in the desired direction. Simply put: any economy, including a transitional one, can be controlled. This book is useful to anyone who wants to increase profits within their business, or improve the quality of their family life and the economic area they live in. It is beneficial for undergraduate and graduate students specializing in the fields of Economic Informatics, Economic Cybernetic...
Modelling the energy transition in cities
Energy Technology Data Exchange (ETDEWEB)
Huber, Felix [Wuppertal Univ. (Germany). Dept. of Civil Engineering; Schwarze, Bjoern; Spiekermann, Klaus; Wegener, Michael [Spiekermann und Wegener Urban and Regional Research, Dortmund (Germany)
2013-09-01
The history of cities is a history of energy transitions. In the medieval city heating and cooking occurred with wood and peat. The growth of the industrial city in the 19th century was built on coal and electricity. The sprawling metropolis of the 20th century was made possible by oil and gas. How will the city of the 21st century look after the next energy transition from fossil to renewable energy? This paper reports on the extension of an urban land-use transport interaction model to a model of the energy transition in the Ruhr Area, a five-million agglomeration in Germany. The paper presents the planned model extensions and how they are to be integrated into the model and shows first preliminary results.
Energy Technology Data Exchange (ETDEWEB)
Omar, M.S., E-mail: dr_m_s_omar@yahoo.com [Department of Physics, College of Science, University of Salahaddin-Erbil, Arbil, Kurdistan (Iraq)
2012-11-15
Graphical abstract: Three models are derived to explain the nanoparticles size dependence of mean bonding length, melting temperature and lattice thermal expansion applied on Sn, Si and Au. The following figures are shown as an example for Sn nanoparticles indicates hilly applicable models for nanoparticles radius larger than 3 nm. Highlights: ► A model for a size dependent mean bonding length is derived. ► The size dependent melting point of nanoparticles is modified. ► The bulk model for lattice thermal expansion is successfully used on nanoparticles. -- Abstract: A model, based on the ratio number of surface atoms to that of its internal, is derived to calculate the size dependence of lattice volume of nanoscaled materials. The model is applied to Si, Sn and Au nanoparticles. For Si, that the lattice volume is increases from 20 Å{sup 3} for bulk to 57 Å{sup 3} for a 2 nm size nanocrystals. A model, for calculating melting point of nanoscaled materials, is modified by considering the effect of lattice volume. A good approach of calculating size-dependent melting point begins from the bulk state down to about 2 nm diameter nanoparticle. Both values of lattice volume and melting point obtained for nanosized materials are used to calculate lattice thermal expansion by using a formula applicable for tetrahedral semiconductors. Results for Si, change from 3.7 × 10{sup −6} K{sup −1} for a bulk crystal down to a minimum value of 0.1 × 10{sup −6} K{sup −1} for a 6 nm diameter nanoparticle.
International Nuclear Information System (INIS)
Omar, M.S.
2012-01-01
Graphical abstract: Three models are derived to explain the nanoparticles size dependence of mean bonding length, melting temperature and lattice thermal expansion applied on Sn, Si and Au. The following figures are shown as an example for Sn nanoparticles indicates hilly applicable models for nanoparticles radius larger than 3 nm. Highlights: ► A model for a size dependent mean bonding length is derived. ► The size dependent melting point of nanoparticles is modified. ► The bulk model for lattice thermal expansion is successfully used on nanoparticles. -- Abstract: A model, based on the ratio number of surface atoms to that of its internal, is derived to calculate the size dependence of lattice volume of nanoscaled materials. The model is applied to Si, Sn and Au nanoparticles. For Si, that the lattice volume is increases from 20 Å 3 for bulk to 57 Å 3 for a 2 nm size nanocrystals. A model, for calculating melting point of nanoscaled materials, is modified by considering the effect of lattice volume. A good approach of calculating size-dependent melting point begins from the bulk state down to about 2 nm diameter nanoparticle. Both values of lattice volume and melting point obtained for nanosized materials are used to calculate lattice thermal expansion by using a formula applicable for tetrahedral semiconductors. Results for Si, change from 3.7 × 10 −6 K −1 for a bulk crystal down to a minimum value of 0.1 × 10 −6 K −1 for a 6 nm diameter nanoparticle.
Energy Technology Data Exchange (ETDEWEB)
Xu, Wen-Sheng, E-mail: wsxu@uchicago.edu [James Franck Institute, The University of Chicago, Chicago, Illinois 60637 (United States); Freed, Karl F., E-mail: freed@uchicago.edu [James Franck Institute, The University of Chicago, Chicago, Illinois 60637 (United States); Department of Chemistry, The University of Chicago, Chicago, Illinois 60637 (United States)
2015-07-14
The lattice cluster theory (LCT) for semiflexible linear telechelic melts, developed in Paper I, is applied to examine the influence of chain stiffness on the average degree of self-assembly and the basic thermodynamic properties of linear telechelic polymer melts. Our calculations imply that chain stiffness promotes self-assembly of linear telechelic polymer melts that assemble on cooling when either polymer volume fraction ϕ or temperature T is high, but opposes self-assembly when both ϕ and T are sufficiently low. This allows us to identify a boundary line in the ϕ-T plane that separates two regions of qualitatively different influence of chain stiffness on self-assembly. The enthalpy and entropy of self-assembly are usually treated as adjustable parameters in classical Flory-Huggins type theories for the equilibrium self-assembly of polymers, but they are demonstrated here to strongly depend on chain stiffness. Moreover, illustrative calculations for the dependence of the entropy density of linear telechelic polymer melts on chain stiffness demonstrate the importance of including semiflexibility within the LCT when exploring the nature of glass formation in models of linear telechelic polymer melts.
Interval Forecast for Smooth Transition Autoregressive Model ...
African Journals Online (AJOL)
In this paper, we propose a simple method for constructing interval forecast for smooth transition autoregressive (STAR) model. This interval forecast is based on bootstrapping the residual error of the estimated STAR model for each forecast horizon and computing various Akaike information criterion (AIC) function. This new ...
Laminar and turbulent melt flow in computational modeling of crystal growth
Czech Academy of Sciences Publication Activity Database
Přikryl, Petr; Jelínek, Pavel; Černý, R.
2002-01-01
Roč. 3, - (2002), s. 201-208 ISSN 1108-7609 R&D Projects: GA ČR GA106/01/0648; GA ČR GA201/01/1200 Institutional research plan: CEZ:AV0Z1019905; CEZ:AV0Z1019905 Keywords : crystal growth * computational model * turbulent melt flow Subject RIV: BK - Fluid Dynamics
A Model for Molten Fuel-Coolant Interaction during Melt Slumping in a Nuclear Reactor
Energy Technology Data Exchange (ETDEWEB)
Sohal, Manohar Singh; Siefken, Larry James
1999-10-01
This paper describes a simple fuel melt slumping model to replace the current parametric model in SCDAP/RELAP5. Specifically, a fuel-coolant interaction (FCI) model is developed to analyze the slumping molten fuel, molten fuel breakup, heat transfer to coolant, relocation of the molten droplets, size of a partially solidified particles that settle to the bottom of the lower plenum, and melt-plenum interaction, if any. Considering our objectives, the molten fuel jet breakup model, and fuel droplets Lagrangian model as included in a code TEXAS-V with Eulerian thermal hydraulics for water and steam from SCDAP/RELAP5 were used. The model was assessed with experimental data from MAGICO-2000 tests performed at University of California at Santa Barbara, and FARO Test L-08 performed at Joint Research Center, Ispra, Italy. The comparison was found satisfactory.
Surface reconstruction precursor to melting in Au309 clusters
Directory of Open Access Journals (Sweden)
Fuyi Chen
2011-09-01
Full Text Available The melting of gold cluster is one of essential properties of nanoparticles and revisited to clarify the role played by the surface facets in the melting transition by molecular dynamics simulations. The occurrence of elaborate surface reconstruction is observed using many-body Gupta potential as energetic model for 309-atom (2.6 nm decahedral, cuboctahedral and icosahedral gold clusters. Our results reveal for the first time a surface reconstruction as precursor to the melting transitions. The surface reconstruction lead to an enhanced melting temperature for (100 faceted decahedral and cuboctahedral cluster than (111 faceted icosahedral gold cluster, which form a liquid patch due to surface vacancy.
Dasgupta, R.; Stalker, K.; Hirschmann, M. M.
2004-12-01
Derivation of highly silica-undersaturated lavas such as olivine melilitites and melilite nephelinites from the mantle has been attributed to the effects of CO2. However, experimental studies have so far failed to demonstrate equilibrium of melilititic melts with a four-phase peridotite assemblage. Instead, the liquidus mineralogy of these silica-undersaturated magmas at high-pressures appears to be dominated by cpx1. Although, experimental partial melts from natural peridotite+CO2 span a continuum from carbonatite to alkali-basalts2, ocean-island melilitites have distinctly higher TiO2, FeO*, and CaO/(CaO+MgO)3,4 than compositions derived thus far from a carbonated lherzolite source. Partial melting experiments of a nominally anhydrous, natural eclogite with a small amount of added carbonate (SLEC1; 5 wt.% bulk CO2) were performed to investigate the transition between carbonate and silicate melts with increasing temperature. Experiments were conducted in a piston cylinder at 3 GPa from 1050 to 1400 ° C. Garnet and cpx appear in all the experiments and ilmenite is observed from 1075 to ˜1200 ° C. An Fe-bearing calcio-dolomitic melt is present from the solidus (1050-1075 ° C) up to 1375 ° C. Beginning at 1275 ° C, it coexists with a silica-poor silicate melt. Textural criteria indicate only a single CO2-rich silicate melt phase at 1400 ° C, coexisting with garnet and minor cpx. The liquidus temperature is estimated to be ˜1415 ° C from the melt fraction-temperature trend. With increasing temperature, the carbonate melt becomes richer in SiO2 ( ˜2 to 5 wt.%) and Al2O3 ( ˜0.75 to 2.25 wt.%) and poorer in CaO ( ˜30 to 25 wt.% from ˜1200 to 1375 ° C). Compositions of silicate partial melts change systematically with increasing temperature, increasing in SiO2 ( ˜36 to 41 wt.%), Al2O3 ( ˜4.5 to 9.5 wt.%), MgO ( ˜9.5 to 13 wt.%), CaO ( ˜8 to 14 wt.%) and decreasing in TiO2 ( ˜14 to 2.5 wt.%), FeO ( ˜20 to 13 wt.%), Na2O ( ˜3.3 to 1.7 wt.%). A wide
Ionic-polymeric models and the amphoteric behavior of water in silicate melts
Moretti, R.
2012-04-01
In silicate melts it is almost impossible to readily distinguish solute and solvent like in aqueous solutions. The anionic framework of silicate melts, in fact, makes solute and solvents so intimately related that one cannot identify a solvation shell and identify directly, from structural studies, the complexes needed to define acid-base reactions. Therefore, the distinction between solute and solvent becomes blurred in systems such as silicate melts, because speciation is not only complex but changes with the marked depolymerization of the silicate framework that obtains from pure SiO2 to metal-oxide rich compositions. These features do not allow proper understanding of the actual physico-chemical role of many species detected by conventional techniques, a fact which can lead to confusing notation. However, these may not be serious limits to account correctly for the acid-base reactions that take place in every kind of magmatic setting, provided a 'syntax' describing the effective interactions among significative cationic and anionic entities. In particular, the syntax for acid-base exchanges is needed such that constituting oxides (i.e. chemical components) can be treated independently of (but not necessarily extraneous to) structural features in defining such entities. So-called ionic-polymeric models highlight the mutual correspondence between polymerization and acid-base properties of dissolved oxides through the Lux-Flood formalism for molten oxides. They thus provide the syntax to write chemical exchanges, but have no pretension to structural description. In fact the concept of melt polymerization is used to identify basic anions and cations that can be used, along with their formal charge, to describe effectively acid-base interactions taking place in melts. In this respect, an example is given by the description of the amphoteric behavior of water dissolved on melts, hence water autoprotolysis. Although it exerts a profound influence on properties of
A Model of Mental State Transition Network
Xiang, Hua; Jiang, Peilin; Xiao, Shuang; Ren, Fuji; Kuroiwa, Shingo
Emotion is one of the most essential and basic attributes of human intelligence. Current AI (Artificial Intelligence) research is concentrating on physical components of emotion, rarely is it carried out from the view of psychology directly(1). Study on the model of artificial psychology is the first step in the development of human-computer interaction. As affective computing remains unpredictable, creating a reasonable mental model becomes the primary task for building a hybrid system. A pragmatic mental model is also the fundament of some key topics such as recognition and synthesis of emotions. In this paper a Mental State Transition Network Model(2) is proposed to detect human emotions. By a series of psychological experiments, we present a new way to predict coming human's emotions depending on the various current emotional states under various stimuli. Besides, people in different genders and characters are taken into consideration in our investigation. According to the psychological experiments data derived from 200 questionnaires, a Mental State Transition Network Model for describing the transitions in distribution among the emotions and relationships between internal mental situations and external are concluded. Further more the coefficients of the mental transition network model were achieved. Comparing seven relative evaluating experiments, an average precision rate of 0.843 is achieved using a set of samples for the proposed model.
What Models and Satellites Tell Us (and Don't Tell Us) About Arctic Sea Ice Melt Season Length
Ahlert, A.; Jahn, A.
2017-12-01
Melt season length—the difference between the sea ice melt onset date and the sea ice freeze onset date—plays an important role in the radiation balance of the Arctic and the predictability of the sea ice cover. However, there are multiple possible definitions for sea ice melt and freeze onset in climate models, and none of them exactly correspond to the remote sensing definition. Using the CESM Large Ensemble model simulations, we show how this mismatch between model and remote sensing definitions of melt and freeze onset limits the utility of melt season remote sensing data for bias detection in models. It also opens up new questions about the precise physical meaning of the melt season remote sensing data. Despite these challenges, we find that the increase in melt season length in the CESM is not as large as that derived from remote sensing data, even when we account for internal variability and different definitions. At the same time, we find that the CESM ensemble members that have the largest trend in sea ice extent over the period 1979-2014 also have the largest melt season trend, driven primarily by the trend towards later freeze onsets. This might be an indication that an underestimation of the melt season length trend is one factor contributing to the generally underestimated sea ice loss within the CESM, and potentially climate models in general.
A Thermal Hydraulic Model of Melt Lubrication in Railgun Armatures
National Research Council Canada - National Science Library
Kothmann, R
2003-01-01
... wear of 7075 aluminum sliding against ETP copper for face pressures ranging from 6 to 22 ksi. Discrepancies between calculated and experimental results are attributed to uncertainties in modeling the complex phase change behavior of aluminum alloy 7075 and uncertain conditions at the rail interface.
Fontenete, Sílvia; Guimarães, Nuno; Wengel, Jesper; Azevedo, Nuno Filipe
2016-01-01
The thermodynamics and kinetics of DNA hybridization, i.e. the process of self-assembly of one, two or more complementary nucleic acid strands, has been studied for many years. The appearance of the nearest-neighbor model led to several theoretical and experimental papers on DNA thermodynamics that provide reasonably accurate thermodynamic information on nucleic acid duplexes and allow estimation of the melting temperature. Because there are no thermodynamic models specifically developed to predict the hybridization temperature of a probe used in a fluorescence in situ hybridization (FISH) procedure, the melting temperature is used as a reference, together with corrections for certain compounds that are used during FISH. However, the quantitative relation between melting and experimental FISH temperatures is poorly described. In this review, various models used to predict the melting temperature for rRNA targets, for DNA oligonucleotides and for nucleic acid mimics (chemically modified oligonucleotides), will be addressed in detail, together with a critical assessment of how this information should be used in FISH.
Melt flow behaviour of poly-epsilon-caprolactone in fused deposition modelling.
Ramanath, H S; Chua, C K; Leong, K F; Shah, K D
2008-07-01
Fused deposition modelling (FDM) is an extrusion based Rapid prototyping (RP) technique which can be used to fabricate tissue engineering scaffolds. The present work focuses on the study of the melt flow behaviour (MFB) of Poly-epsilon-caprolactone (PCL) as a representative biomaterial, on the FDM. The MFB significantly affects the quality of the scaffold which depends not only on the pressure gradient, its velocity, and the temperature gradients but also physical properties like the melt temperature and rheology. The MFB is studied using two methods: mathematical modelling and finite element analysis (FEA) using Ansys(R). The MFB is studied using accurate channel geometry by varying filament velocity at the entry and by varying nozzle diameters and angles at the exit. The comparative results of both mathematical modelling and FEA suggest that the pressure drop and the velocities of the melt flow depend on the flow channel parameters. One inference of particular interest is the temperature gradient of the PCL melt, which shows that it liquefies within 35% of the channel length. These results are invaluable to better understand the MFB of biomaterials that affects the quality of the scaffold built via FDM and can also be used to predict the MFB of other biomaterials.
Fettweis, X.; Tedesco, M.; van den Broeke, M.R.; Ettema, J.
2011-01-01
To study near-surface melt changes over the Greenland ice sheet (GrIS) since 1979, melt extent estimates from two regional climate models were compared with those obtained from spaceborne microwave brightness temperatures using two different remote sensing algorithms. The results from the two models
Römer, Gerardus Richardus, Bernardus, Engelina; Meijer, J.; Beckmann, Leo H.J.F.
1997-01-01
Laser surface treatment, more specifically laser - (re)melting, -alloying and -dispersing, are techniques for improving wear, fatigue and erosion resistance of mechanical parts, using high power lasers. Analytical models which decrease these processes in a simplified way can be helpful for (a)
Room temperature magneto-structural transition in Al for Sn substituted Ni–Mn–Sn melt spun ribbons
Energy Technology Data Exchange (ETDEWEB)
Maziarz, W. [Institute of Metallurgy and Materials Science, Polish Academy of Sciences, 25 W. Reymonta Str., 30-059 Kraków (Poland); Czaja, P., E-mail: p.czaja@imim.pl [Institute of Metallurgy and Materials Science, Polish Academy of Sciences, 25 W. Reymonta Str., 30-059 Kraków (Poland); Szczerba, M.J. [Institute of Metallurgy and Materials Science, Polish Academy of Sciences, 25 W. Reymonta Str., 30-059 Kraków (Poland); Przewoźnik, J.; Kapusta, C. [AGH University of Science and Technology, Faculty of Physics and Applied Computer Science, Department of Solid State Physics, Al. Mickiewicza 30, 30-059 Krakow (Poland); Żywczak, A.; Stobiecki, T. [AGH University of Science and Technology, Department of Electronics, Al. Mickiewicza 30, 30-059 Kraków (Poland); Cesari, E. [Department de Fisica, Universitat de Illes Balears, Ctra. de Valldemossa, km 7.5, Palma de Mallorca E-07071 (Spain); Dutkiewicz, J. [Institute of Metallurgy and Materials Science, Polish Academy of Sciences, 25 W. Reymonta Str., 30-059 Kraków (Poland)
2013-12-15
Martensitic and magnetic transformations in Ni{sub 48}Mn{sub 39.5}Sn{sub 12.5−x}Al{sub x} (x=0, 1, 2, 3) Heusler alloy ribbons were investigated. It is demonstrated that both magnetic and structural transformations occur in all of the studied samples. It is also shown that substitution of Sn with Al causes the martensitic transformation (MT) and the reverse martensitic transformation (RMT) temperatures to increase to room temperature (ΔT{sub MT}=49 K; ΔT{sub RMT}=43 K), whereas the Curie temperature of martensite T{sub C}{sup M} decreases (ΔT=36 K) and the Curie temperature of austenite T{sub C}{sup A} remains practically insensitive to Al introduction. This then allows to tune T{sub C}{sup A} and the MT temperature leading to their coincidence at ambient temperature. The austenite phase with the L2{sub 1} type structure has been identified to exist in all the samples regardless of composition. On the other hand the structure of martensite has been shown to be sensitive to composition. It has been determined as the 10 M martensite with (32{sup ¯}) stacking sequence in Al free samples and the 4O martensite with the stacking periodicity (31{sup ¯}) in Al containing samples. In addition, the splitting of the field cooling (FC) and the field heating (FH) thermo-magnetic curves at low (50 Oe) magnetic field and below the T{sub C}{sup M} has been attributed to intermartensitic transition. The application of large magnetic field (50 kOe) has shown the existence of two distinct ferromagnetic states with a considerable hysteresis loop. The properties of these materials make them promising for magnetocaloric applications. - Highlights: • Al for Sn substituted Ni–Mn–Sn based ferromagnetic Heusler alloys were produced by melt spinning. • Martensitic, reverse martensitic and intermartensitic transformations were observed, their temperatures and magnitude changed with Al substitution. • Different types of martensite structures were identified depending on Al
Mathematical modeling of municipal solid waste plasma gasification in a fixed-bed melting reactor
Zhang, Qinglin
2011-01-01
The increasing yield of municipal solid waste (MSW) is one of the main by-products of modern society. Among various MSW treatment methods, plasma gasification in a fixed-bed melting reactor (PGM) is a new technology, which may provide an efficient and environmental friendly solution for problems related to MSW disposals. General objectives of this work are to develop mathematical models for the PGM process, and using these models to analyze the characteristics of this new technology. In this ...
Culture in Transition: A learning model
DEFF Research Database (Denmark)
Baca, Susan
2010-01-01
of spare capacity, desire, focus, and information. By integrating the element of culture, both in the organizational sense and that pertaining to diversity, otherwise overseen aspects of transition are brought into view, with the potential of reducing stress and increasing job satisfaction. The model...
Effect Of Turbulence Modelling In Numerical Analysis Of Melting Process In An Induction Furnace
Directory of Open Access Journals (Sweden)
Buliński P.
2015-09-01
Full Text Available In this paper, the velocity field and turbulence effects that occur inside a crucible of a typical induction furnace were investigated. In the first part of this work, a free surface shape of the liquid metal was measured in a ceramic crucible. Then a numerical model of aluminium melting process was developed. It took into account coupling of electromagnetic and thermofluid fields that was performed using commercial codes. In the next step, the sensitivity analysis of turbulence modelling in the liquid domain was performed. The obtained numerical results were compared with the measurement data. The performed analysis can be treated as a preliminary approach for more complex mathematical modelling for the melting process optimisation in crucible induction furnaces of different types.
Modeling Network Transition Constraints with Hypergraphs
DEFF Research Database (Denmark)
Harrod, Steven
2011-01-01
Discrete time dynamic graphs are frequently used to model multicommodity flows or activity paths through constrained resources, but simple graphs fail to capture the interaction effects of resource transitions. The resulting schedules are not operationally feasible, and return inflated objective...... values. A directed hypergraph formulation is derived to address railway network sequencing constraints, and an experimental problem sample solved to estimate the magnitude of objective inflation when interaction effects are ignored. The model is used to demonstrate the value of advance scheduling...
Modeling and Experimental Validation of the Electron Beam Selective Melting Process
Directory of Open Access Journals (Sweden)
Wentao Yan
2017-10-01
Full Text Available Electron beam selective melting (EBSM is a promising additive manufacturing (AM technology. The EBSM process consists of three major procedures: ① spreading a powder layer, ② preheating to slightly sinter the powder, and ③ selectively melting the powder bed. The highly transient multi-physics phenomena involved in these procedures pose a significant challenge for in situ experimental observation and measurement. To advance the understanding of the physical mechanisms in each procedure, we leverage high-fidelity modeling and post-process experiments. The models resemble the actual fabrication procedures, including ① a powder-spreading model using the discrete element method (DEM, ② a phase field (PF model of powder sintering (solid-state sintering, and ③ a powder-melting (liquid-state sintering model using the finite volume method (FVM. Comprehensive insights into all the major procedures are provided, which have rarely been reported. Preliminary simulation results (including powder particle packing within the powder bed, sintering neck formation between particles, and single-track defects agree qualitatively with experiments, demonstrating the ability to understand the mechanisms and to guide the design and optimization of the experimental setup and manufacturing process.
Advanced Modeling of Cold Crucible Induction Melting for Process Control and Optimization
Energy Technology Data Exchange (ETDEWEB)
J. A. Roach; D. B. Lopukh; A. P. Martynov; B. S. Polevodov; S. I. Chepluk
2008-02-01
The Idaho National Laboratory (INL) and the St. Petersburg Electrotechnical University “LETI” (ETU) have collaborated on development and validation of an advanced numerical model of the cold crucible induction melting (CCIM) process. This work was conducted in support of the Department of Energy (DOE) Office of Environmental Management Technology and Engineering (EM-20) International Program. The model predicts quasi-steady state temperature distributions, convection cell configurations, and flow field velocities for a fully established melt of low conductivity non-magnetic materials at high frequency operations. The INL/ETU ANSYS© finite element model is unique in that it has been developed specifically for processing borosilicate glass (BSG) and other glass melts. Specifically, it accounts for the temperature dependency of key material properties, some of which change by orders of magnitude within the temperature ranges experienced (temperature differences of 500oC are common) in CCIM processing of glass, including density, viscosity, thermal conductivity, specific heat, and electrical resistivity. These values, and their responses to temperature changes, are keys to understanding the melt characteristics. Because the model has been validated, it provides the capability to conduct parametric studies to understand operational sensitivities and geometry effects. Additionally, the model can be used to indirectly determine difficult to measure material properties at higher temperatures such as resistivity, thermal conductivity and emissivity. The model can also be used to optimize system design and to predict operational behavior for specific materials and system configurations, allowing automated feedback control. This becomes particularly important when designing melter systems for full-scale industrial applications.
Modelling Transition Towards Sustainable Transportation Sector
DEFF Research Database (Denmark)
Dominkovic, Dominik Franjo; Bačeković, I.; Mýrdal, Jón Steinar Garðarsson
2016-01-01
two energy sectors. In order to deal with the raised issue, authors of this paper developed amethodology for calculation of the transition towards sustainable transport sector, focusing on thesolutions that are already available. Furthermore, as a part of the model, a detailed mapping ofresources......In a transition towards 100% renewable energy system, transportation sector is rarely dealt withusing the holistic approach and measuring its impact on the whole energy system. Furthermore, assolutions for power and heat sectors are clearer, it is a tendency of the researchers to focus on thelatter...... needed has been carried out for each of the alternatives. It was shown that theelectrification of the transportation sector is a crucial point in transition, while for the transportmodes that cannot be electrified, or shifted to different transportation modes, four alternatives weredefined: synthetic...
Mandal, Nibir; Sarkar, Shamik; Baruah, Amiya; Dutta, Urmi
2018-04-01
Using an enthalpy based thermo-mechanical model we provide a theoretical evaluation of melt production beneath mid-ocean ridges (MORs), and demonstrate how the melts subsequently develop their pathways to sustain the major ridge processes. Our model employs a Darcy idealization of the two-phase (solid-melt) system, accounting enthalpy (ΔH) as a function of temperature dependent liquid fraction (ϕ). Random thermal perturbations imposed in this model set in local convection that drive melts to flow through porosity controlled pathways with a typical mushroom-like 3D structure. We present across- and along-MOR axis model profiles to show the mode of occurrence of melt-rich zones within mushy regions, connected to deeper sources by single or multiple feeders. The upwelling of melts experiences two synchronous processes: 1) solidification-accretion, and 2) eruption, retaining a large melt fraction in the framework of mantle dynamics. Using a bifurcation analysis we determine the threshold condition for melt eruption, and estimate the potential volumes of eruptible melts (∼3.7 × 106 m3/yr) and sub-crustal solidified masses (∼1-8.8 × 106 m3/yr) on an axis length of 500 km. The solidification process far dominates over the eruption process in the initial phase, but declines rapidly on a time scale (t) of 1 Myr. Consequently, the eruption rate takes over the solidification rate, but attains nearly a steady value as t > 1.5 Myr. We finally present a melt budget, where a maximum of ∼5% of the total upwelling melt volume is available for eruption, whereas ∼19% for deeper level solidification; the rest continue to participate in the sub-crustal processes.
Investigating melting induced mantle heterogeneities in plate driven mantle convection models
Price, M.; Davies, H.; Panton, J.
2017-12-01
Observations from geochemistry and seismology continue to suggest a range of complex heterogeneity in Earth's mantle. In the deep mantle, two large low velocity provinces (LLVPs) have been regularly observed in seismic studies, with their longevity, composition and density compared to the surrounding mantle debated. The cause of these observed LLVPs is equally uncertain, with previous studies advocating either thermal or thermo-chemical causes. There is also evidence that these structures could provide chemically distinct reservoirs within the mantle, with recent studies also suggesting there may be additional reservoirs in the mantle, such as bridgmanite-enriched ancient mantle structures (BEAMS). One way to test these hypotheses is using computational models of the mantle, with models that capture the full 3D system being both complex and computationally expensive. Here we present results from our global mantle model TERRA. Using our model, we can track compositional variations in the convecting mantle that are generated by self-consistent, evolving melting zones. Alongside the melting, we track trace elements and other volatiles which can be partitioned during melting events, and expelled and recycled at the surface. Utilising plate reconstruction models as a boundary condition, the models generate the tectonic features observed at Earth's surface, while also organising the lower mantle into recognisable degree-two structures. This results in our models generating basaltic `oceanic' crusts which are then brought into the mantle at tectonic boundaries, providing additional chemical heterogeneity in the mantle volume. Finally, by utilising thermodynamic lookup tables to convert the final outputs from the model to seismic structures, together with resolution filters for global tomography models, we are able to make direct comparisons between our results and observations. By varying the parameters of the model, we investigate a range of current hypotheses for
Impact of melt ponds on Arctic sea ice in the HadGEM3 global coupled climate model
Schroeder, David; Rae, Jamie; Feltham, Daniel; Flocco, Daniela; Tsamados, Michel; Ridley, Jeff; Keen, Ann
2015-04-01
Stand-alone sea ice simulations with a physical based melt pond model reveal a strong correlation between the simulated spring pond fraction and the observed as well as simulated September sea ice extent for the period 1979 to 2014. This is explained by a positive feedback mechanism: more ponds reduce the albedo; a lower albedo causes more melting; more melting increases pond fraction. This feedback process is a potential reason for the acceleration of Arctic sea ice decrease in the last decade and the failure of many climate models (without an implicit pond model) to simulate the observed decrease. We implemented the Los Alamos sea ice model CICE 5 including our physical based melt pond model into the latest version of the Hadley Centre coupled climate model, HadGEM3. The model surface shortwave radiation scheme has been adjusted to account for pond fraction and depth. A 30-year simulation with constant present-day atmospheric C02 has been undertaken. The sensitivity of the simulated sea ice area and volume to parameters pertinent to the melt pond parameterization will be discussed and compared to those in uncoupled (forced) simulations. The analysis focuses on the impact of melt ponds on the summer melt, and asks if the strong correlation between spring pond fraction and September sea ice extent found in stand-alone simulations, can be confirmed in the coupled climate simulation.
A porous flow approach to model thermal non-equilibrium applicable to melt migration
Schmeling, Harro; Marquart, Gabriele; Grebe, Michael
2018-01-01
where melt focuses into melt channels near the transition to melt ascent by dykes. Our method is based on solving the convolution integration for the heat exchange over the full flow history, which is numerically expensive. We tested to replace the heat exchange term by an instantaneous, approximate term. We found considerable errors on the short timescale, but a good agreement on the long timescale if appropriate parameters for the approximate terms are used. We derived these parameters which may be implemented in fully dynamical two-phase flow formulations of melt migration in the Earth.
Melting under shock compression
International Nuclear Information System (INIS)
Bennett, B.I.
1980-10-01
A simple model, using experimentally measured shock and particle velocities, is applied to the Lindemann melting formula to predict the density, temperature, and pressure at which a material will melt when shocked from room temperature and zero pressure initial conditions
Cullather, Richard; Nowicki, Sophie; Zhao, Bin; Koenig, Lora
2016-02-01
For the Greenland Ice Sheet (GrIS), large-scale melt area has increased in recent years and is detectable via remote sensing, but its relation to runoff is not known. Historical, modeled melt area and runoff from Modern-Era Retrospective Analysis for Research and Applications (MERRA-Replay), the Interim Re-Analysis of the European Centre for Medium Range Weather Forecasts (ERA-I), the Climate Forecast System Reanalysis (CFSR), the Modèle Atmosphérique Régional (MAR), and the Arctic System Reanalysis (ASR) are examined. These sources compare favorably with satellite-derived estimates of surface melt area for the period 2000-2012. Spatially, the models markedly disagree on the number of melt days in the interior of the southern part of the ice sheet, and on the extent of persistent melt areas in the northeastern GrIS. Temporally, the models agree on the mean seasonality of daily surface melt and on the timing of large-scale melt events in 2012. In contrast, the models disagree on the amount, seasonality, spatial distribution, and temporal variability of runoff. As compared to global reanalyses, time series from MAR indicate a lower correlation between runoff and melt area (r2 = 0.805). Runoff in MAR is much larger in the second half of the melt season for all drainage basins, while the ASR indicates larger runoff in the first half of the year. This difference in seasonality for the MAR and to an extent for the ASR provide a hysteresis in the relation between runoff and melt area, which is not found in the other models. The comparison points to a need for reliable observations of surface runoff.
International Nuclear Information System (INIS)
Miettinen, Jaakko; Hamalainen, Anitta; Pekkarinen, Esko
2002-01-01
Thermal hydraulic simulation capability for accident conditions is needed at present in VTT in several programs. Traditional thermal hydraulic models are too heavy for simulation in the analysis tasks, where the main emphasis is the rapid neutron dynamics or the core melting. The GENFLO thermal hydraulic model has been developed at VTT for special applications in the combined codes. The basic field equations in GENFLO are for the phase mass, the mixture momentum and phase energy conservation equations. The phase separation is solved with the drift flux model. The basic variables to be solved are the pressure, void fraction, mixture velocity, gas enthalpy, liquid enthalpy, and concentration of non-condensable gas fractions. The validation of the thermohydraulic solution alone includes large break LOCA reflooding experiments and in specific for the severe accident conditions QUENCH tests. In the recriticality analysis the core neutronics is simulated with a two-dimensional transient neutronics code TWODIM. The recriticality with one rapid prompt peak is expected during a severe accident scenario, where the control rods have been melted and ECCS reflooding is started after the depressurization. The GENFLO module simulates the BWR thermohydraulics in this application. The core melting module has been developed for the real time operator training by using the APROS engineering simulators. The core heatup, oxidation, metal and fuel pellet relocation and corium pool formation into the lower plenum are calculated. In this application the GENFLO model simulates the PWR vessel thermohydraulics. In the fuel performance analysis the fuel rod transient behavior is simulated with the FRAPTRAN code. GENFLO simulates the subchannel around a single fuel rod and delivers the heat transfer on the cladding surface for the FRAPTRAN. The transient boundary conditions for the subchannel are transmitted from the system code for operational transient, loss of coolant accidents and
Non-linear two-dimensional model of melt flows and interface instability in aluminum reduction cells
Sun, Haijun; Zikanov, Oleg; Ziegler, Donald P.
2004-10-01
We derive a new two-dimensional model for the melt flows and interface instability in aluminum reduction cells. The model is based on the de St. Venant shallow water equations and incorporates the essential features of the system such as the magnetohydrodynamic instability mechanism and non-linear coupling between the flows and interfacial waves. The model is applied to investigate the impact of background melt flows and magnetic field perturbations on the instability.
Transition sum rules in the shell model
Lu, Yi; Johnson, Calvin W.
2018-03-01
An important characterization of electromagnetic and weak transitions in atomic nuclei are sum rules. We focus on the non-energy-weighted sum rule (NEWSR), or total strength, and the energy-weighted sum rule (EWSR); the ratio of the EWSR to the NEWSR is the centroid or average energy of transition strengths from an nuclear initial state to all allowed final states. These sum rules can be expressed as expectation values of operators, which in the case of the EWSR is a double commutator. While most prior applications of the double commutator have been to special cases, we derive general formulas for matrix elements of both operators in a shell model framework (occupation space), given the input matrix elements for the nuclear Hamiltonian and for the transition operator. With these new formulas, we easily evaluate centroids of transition strength functions, with no need to calculate daughter states. We apply this simple tool to a number of nuclides and demonstrate the sum rules follow smooth secular behavior as a function of initial energy, as well as compare the electric dipole (E 1 ) sum rule against the famous Thomas-Reiche-Kuhn version. We also find surprising systematic behaviors for ground-state electric quadrupole (E 2 ) centroids in the s d shell.
Czech Academy of Sciences Publication Activity Database
Cincibusová, Petra; Němec, L.
2015-01-01
Roč. 56, č. 2 (2015), s. 52-62 ISSN 1753-3546 R&D Projects: GA TA ČR TA01010844 Institutional support: RVO:67985891 Keywords : glass melt * mathematical modelling * controlled flow * space utilization * temperature gradients Subject RIV: JH - Ceramics, Fire-Resistant Materials and Glass Impact factor: 0.362, year: 2015 http://www.ingentaconnect.com/content/sgt/gta/2015/00000056/00000002/art00003
Modification of Pawlow's thermodynamical model for the melting of small single-component particles
Barybin, Anatoly; Shapovalov, Victor
2011-02-01
A new approach to the melting of small particles is proposed to modify the known Pawlow's model by taking into account the transfer of material from solid spherical particles to liquid ones through a gas phase. Thermodynamical analysis gives rise to a differential equation for the melting point Tm involving such size-dependent and temperature-dependent parameters of a material as the surface tensions σs(l ), molar heat of fusion ΔHm and molar volumes vs(l ). Solution of this equation has shown that all the limiting cases for size-independent situations coincide with results known in the literature and our analysis of size-dependent situations gives results close to the experimental data previously obtained by other authors for some metallic particles.
Effect of water on mantle melting and magma differentiation, as modeled using Adiabat_1ph 3.0
Antoshechkina, P. M.; Asimow, P. D.; Hauri, E. H.; Luffi, P. I.
2010-12-01
MELTS [1] and pMELTS [2] are widely used for modeling hydrous magma differentiation and water-saturated mantle melting, respectively. In pHMELTS [3] the water species can partition into melt, pure vapor, and hydrous or nominally anhydrous minerals so that phase relations for water-undersaturated systems may also be constructed. Adiabat_1ph is a text-based front end to the (pH)MELTS algorithms; in version 3.0 (Antoshechkina and Asimow, this meeting) we have added tools to further explore the effect of water on melting and fractional crystallization. Asimow and coworkers developed two schemes for fractionation-correction of major and trace elements: a forward model that considers the effects of water, pressure, and fO2 on the liquid line of descent (LLD) [3] and a hybrid back- and forward-fractionation model that may be used for individual samples when trends are poorly defined [4]. An extensive melt inclusion dataset for the Mariana Trough [5] shows evidence for simultaneous fractionation and degassing, so we have adapted routines from [4] to cope with hydrous conditions. For H2O approached as incremental feed of the same agent into a solid whose composition progressively modifies as it reacts with melt. The observation that incremental flux melting of peridotites leads to a broader diversity and steeper gradients in residue compositions than batch fluxing [6] also holds for water-fluxed melting of peridotites. Liquids resulting from the two mechanisms differ most at the point of highest melt/rock ratio. Melts generated by incremental fluxing are poorer in Si and richer in Al and Fe than those resulting from batch water addition, implying that hydrous melts traversing the lithosphere via porous flow tend to appear deeper and hotter than do melts traveling in conduits. [1] Ghiorso & Sack 1995 CMP [2] Ghiorso et al. 2002 [3] Asimow et al. 2004 [4] Cooper et al 2004 EPSL [5] Shaw, Hauri et al., in prep [6] Luffi et al. 2009 EOS
Directory of Open Access Journals (Sweden)
A. Parajuli
2015-05-01
Full Text Available In the Nepalese Himalayas, the complex topography, occurrence of debris covered glaciers, and limited data availability creates substantial difficulties for modelling glacier melt. The proper recognition of melt processes governs the accurate estimation of melt water from glacier dominated systems, even in the presence of debris-covered glaciers. This paper presents a glacier melt model developed for the Lirung sub-basin of Langtang valley, which has both a clean glacier area, 5.86 km2, and a debris-covered glacier area, 1.13 km2. We use a temperature index approach to estimate sub-daily melt water discharge for a two week period at the end of monsoon, and the melt factor is varied according to the aspect and distributed to each grid processed from the digital elevation model. The model uses easily available data and simple extrapolation techniques capable of generating melt with limited data. The result obtained from this method provides accurate estimate with an R2 value of 0.89, bias of 0.9% and Nash-Sutcliffe efficiency of 0.86, and suitable in Himalaya where data availability is major issue.
Simulation Model of Bus Rapid Transit
Directory of Open Access Journals (Sweden)
Gunawan Fergyanto E.
2014-03-01
Full Text Available Bus rapid transit system is modern solution for mass transportation system. The system, in comparison to the rail-based transportation system, is significantly cheaper and requires shorter development time, but lower performance. The BRT system performance strongly depends on variables related to station design and infrastructure. A numerical model offers an effective and efficient means to evaluate the system performance. This article offers a detailed numerical model on the basis of the discrete-event approach and demonstrates its application.
Asad, Amjad; Bauer, Katrin; Chattopadhyay, Kinnor; Schwarze, Rüdiger
2018-02-01
In the paper, a new water model of the turbulent recirculating flow in an induction furnace is introduced. The water model was based on the principle of the stirred vessel used in process engineering. The flow field in the water model was measured by means of particle image velocimetry in order to verify the model's performance. Here, it is indicated that the flow consists of two toroidal vortices similar to the flow in the induction crucible furnace. Furthermore, the turbulent flow in the water model is investigated numerically by adopting eddy-resolving turbulence modeling. The two toroidal vortices occur in the simulations as well. The numerical approaches provide identical time-averaged flow patterns. Moreover, a good qualitative agreement is observed on comparing the experimental and numerical results. In addition, a numerical simulation of the melt flow in a real induction crucible furnace was performed. The turbulent kinetic energy spectrum of the flow in the water model was compared to that of the melt flow in the induction crucible furnace to show the similarity in the nature of turbulence.
Modeling of the Melting Process in an AdBlue Tank
Klinga, Emil
2015-01-01
This master thesis is covering the modeling of the melting process in a tank filled with AdBlue. Due to AdBlue freezing at temperatures below -11 degree there is a need to add heat to be able to secure dosing in all situations. A rig for simulating freezing conditions is created with the possibility to store AdBlue in temperatures down to -40 degree. Temperatures are measured in and around the tank containing AdBlue and in the equipment used for adding heat. Two models are created from physic...
Karakoti, Indira; Kesarwani, Kapil; Mehta, Manish; Dobhal, D. P.
2016-10-01
Two enhanced temperature-index (T-index) models are proposed by incorporating meteorological parameters viz. relative humidity, wind speed and net radiation. The models are an attempt to explore different climatic variables other than temperature affecting glacier surface melting. Weather data were recorded at Chorabari Glacier using an automatic weather station during the summers of 2010 (July 10 to September 10) and 2012 (June 10 to October 25). The modelled surface melt is validated against the measured point surface melting at the snout. Performance of the developed models is evaluated by comparing with basic temperature-index model and is quantified through different efficiency criteria. The results suggest that proposed models yield considerable improvement in surface melt simulation . Consequently, the study reveals that glacier surface melt depends not only on temperature but also on weather parameters viz. relative humidity, wind speed and net radiation play a significant role in glacier surface melting. This approach provides a major improvement on basic temperature-index method and offers an alternative to energy balance model.
International Nuclear Information System (INIS)
Petukhov, S.M.; Zemlianoukhin, V.V.
1992-01-01
The analysis of the process of heat transfer between molten corium and concrete in the case of severe accident in a PWR is performed. It is shown that Bradley's model may be improved for the case of an oxidic melt. A new model is developed and incorporated in the WECHSL-Mod2 Code. Post-test calculations of melt-concrete interaction experiments are carried out. The comparison and analysis of the experimental results and calculations are presented. (9 figures) (Author)
Model-independent Exoplanet Transit Spectroscopy
Aronson, Erik; Piskunov, Nikolai
2018-05-01
We propose a new data analysis method for obtaining transmission spectra of exoplanet atmospheres and brightness variation across the stellar disk from transit observations. The new method is capable of recovering exoplanet atmosphere absorption spectra and stellar specific intensities without relying on theoretical models of stars and planets. We simultaneously fit both stellar specific intensity and planetary radius directly to transit light curves. This allows stellar models to be removed from the data analysis. Furthermore, we use a data quality weighted filtering technique to achieve an optimal trade-off between spectral resolution and reconstruction fidelity homogenizing the signal-to-noise ratio across the wavelength range. Such an approach is more efficient than conventional data binning onto a low-resolution wavelength grid. We demonstrate that our analysis is capable of reproducing results achieved by using an explicit quadratic limb-darkening equation and that the filtering technique helps eliminate spurious spectral features in regions with strong telluric absorption. The method is applied to the VLT FORS2 observations of the exoplanets GJ 1214 b and WASP-49 b, and our results are in agreement with previous studies. Comparisons between obtained stellar specific intensity and numerical models indicates that the method is capable of accurately reconstructing the specific intensity. The proposed method enables more robust characterization of exoplanetary atmospheres by separating derivation of planetary transmission and stellar specific intensity spectra (that is model-independent) from chemical and physical interpretation.
Mott transitions in the periodic Anderson model
International Nuclear Information System (INIS)
Logan, David E; Galpin, Martin R; Mannouch, Jonathan
2016-01-01
The periodic Anderson model (PAM) is studied within the framework of dynamical mean-field theory, with particular emphasis on the interaction-driven Mott transition it contains, and on resultant Mott insulators of both Mott–Hubbard and charge-transfer type. The form of the PAM phase diagram is first deduced on general grounds using two exact results, over the full range of model parameters and including metallic, Mott, Kondo and band insulator phases. The effective low-energy model which describes the PAM in the vicinity of a Mott transition is then shown to be a one-band Hubbard model, with effective hoppings that are not in general solely nearest neighbour, but decay exponentially with distance. This mapping is shown to have a range of implications for the physics of the problem, from phase boundaries to single-particle dynamics; all of which are confirmed and supplemented by NRG calculations. Finally we consider the locally degenerate, non-Fermi liquid Mott insulator, to describe which requires a two-self-energy description. This is shown to yield a number of exact results for the associated local moment, charge, and interaction-renormalised levels, together with a generalisation of Luttinger’s theorem to the Mott insulator. (paper)
Condon, Joshua E; Jayaraman, Arthi
2018-02-15
In this paper, we present the development of a phenomenological coarse-grained model that represents single strands of collagen-like peptides (CLPs) as well as CLP triple helices. The goal of this model development is to enable coarse-grained molecular simulations of solutions of CLPs and conjugates of CLPs with other macromolecules and to predict trends in the CLP melting temperature with varying CLP design, namely CLP length and composition. Since the CLP triple helix is stabilized primarily by hydrogen bonds between amino acids in adjacent strands, for modeling CLP melting we get inspiration from a recent coarse-grained (CG) model that was used to capture specific and directional hydrogen-bonding interactions in base-pair hybridization within oligonucleotides and reproduced known DNA melting trends with DNA sequence and composition in implicit water. In this paper, we systematically describe the changes we make to this original CG model and then show that these improvements reproduce the known melting trends of CLPs seen in past experiments. Specifically, the CG simulations of CLP solutions at experimentally relevant concentrations show increasing melting temperature with increasing CLP length and decreasing melting temperature with incorporation of charged residues in place of uncharged residues in the CLP, in agreement with past experimental observations. Finally, results from simulations of CLP triple helices conjugated with elastin like peptides (ELPs), using this new CG model of CLP, reproduce the same trends in ELP aggregation as seen in past experiments.
A snow and ice melt seasonal prediction modelling system for Alpine reservoirs
Förster, Kristian; Oesterle, Felix; Hanzer, Florian; Schöber, Johannes; Huttenlau, Matthias; Strasser, Ulrich
2016-10-01
The timing and the volume of snow and ice melt in Alpine catchments are crucial for management operations of reservoirs and hydropower generation. Moreover, a sustainable reservoir operation through reservoir storage and flow control as part of flood risk management is important for downstream communities. Forecast systems typically provide predictions for a few days in advance. Reservoir operators would benefit if lead times could be extended in order to optimise the reservoir management. Current seasonal prediction products such as the NCEP (National Centers for Environmental Prediction) Climate Forecast System version 2 (CFSv2) enable seasonal forecasts up to nine months in advance, with of course decreasing accuracy as lead-time increases. We present a coupled seasonal prediction modelling system that runs at monthly time steps for a small catchment in the Austrian Alps (Gepatschalm). Meteorological forecasts are obtained from the CFSv2 model. Subsequently, these data are downscaled to the Alpine Water balance And Runoff Estimation model AWARE running at monthly time step. Initial conditions are obtained using the physically based, hydro-climatological snow model AMUNDSEN that predicts hourly fields of snow water equivalent and snowmelt at a regular grid with 50 m spacing. Reservoir inflow is calculated taking into account various runs of the CFSv2 model. These simulations are compared with observed inflow volumes for the melting and accumulation period 2015.
Electron Beam Melting and Refining of Metals: Computational Modeling and Optimization
Directory of Open Access Journals (Sweden)
Veliko Donchev
2013-10-01
Full Text Available Computational modeling offers an opportunity for a better understanding and investigation of thermal transfer mechanisms. It can be used for the optimization of the electron beam melting process and for obtaining new materials with improved characteristics that have many applications in the power industry, medicine, instrument engineering, electronics, etc. A time-dependent 3D axis-symmetrical heat model for simulation of thermal transfer in metal ingots solidified in a water-cooled crucible at electron beam melting and refining (EBMR is developed. The model predicts the change in the temperature field in the casting ingot during the interaction of the beam with the material. A modified Pismen-Rekford numerical scheme to discretize the analytical model is developed. These equation systems, describing the thermal processes and main characteristics of the developed numerical method, are presented. In order to optimize the technological regimes, different criteria for better refinement and obtaining dendrite crystal structures are proposed. Analytical problems of mathematical optimization are formulated, discretized and heuristically solved by cluster methods. Using important for the practice simulation results, suggestions can be made for EBMR technology optimization. The proposed tool is important and useful for studying, control, optimization of EBMR process parameters and improving of the quality of the newly produced materials.
Leroux, Nicolas R.; Pomeroy, John W.
2017-09-01
Accurate estimation of the amount and timing of water flux through melting snowpacks is important for runoff prediction in cold regions. Most existing snowmelt models only account for one-dimensional matrix flow and neglect to simulate the formation of preferential flow paths. Consideration of lateral and preferential flows has proven critical to improve the performance of soil and groundwater porous media flow models. A two-dimensional physically-based snowpack model that simulates snowmelt, refreezing of meltwater, heat and water flows, and preferential flow paths is presented. The model assumes thermal equilibrium between solid and liquid phases and uses recent snow physics advances to estimate snowpack hydraulic and thermal properties. For the first time, capillary hysteresis is accounted in a snowmelt model. A finite volume method is applied to solve for the 2D coupled heat and mass transfer equations. The model with capillary hysteresis provided better simulations of water suction at the wet to dry snow interface in a wetting snow sample than did a model that only accounted for the boundary drying curve. Capillary hysteresis also improved simulations of preferential flow path dynamics and the snowpack discharge hydrograph. Simulating preferential flow in a subfreezing snowpack allowed the model to generate ice layers, and increased the vertical exchange of energy, thus modelling a faster warming of the snowpack than would be possible without preferential flow. The model is thus capable of simulating many attributes of heterogeneous natural melting snowpacks. These features not only qualitatively improve water flow simulations, but improve the understanding of snowmelt flow processes for both level and sloping terrain, and illuminate how uncertainty in snowmelt-derived runoff calculations might be reduced through the inclusion of more realistic preferential flow through snowpacks.
Energy Technology Data Exchange (ETDEWEB)
Menegotto Costa, R. [Instituto de Matemática, Estatística e Física, Universidade Federal do Rio Grande (FURG), Campus Carreiros, Rio Grande, RS (Brazil); Dias, F.T. [Instituto de Física e Matemática, Universidade Federal de Pelotas (UFPel), Caixa Postal 354, 96010-900 Pelotas, RS (Brazil); Pureur, P., E-mail: ppureur@if.ufrgs.br [Instituto de Física, Universidade Federal do Rio Grande do Sul (UFRGS), Caixa Postal 15051, 91501-970 Porto Alegre, RS (Brazil); Obradors, X. [Institut de Ciéncia de Materials de Barcelona, CSIC, Universitat Autònoma de Barcelona, 08193 Bellaterra (Spain)
2013-12-15
Highlights: •We report on experimental measurements of the temperature derivative of the resistivity in the region encompassing the superconducting transition in melt-textured samples of the YBa{sub 2}Cu{sub 3}O{sub 7−d} cuprate superconductor. •A complex and subtle multi-peak structure is observed in d{ρ}/dT. •We develop a new method to quantitatively describe the resistive transition of a multi-phased superconductor. •The pseudo-spectral structure observed in d{ρ}/dT is ascribed to a phase separation phenomenon driven by the ordering of labile oxygen atoms in the Cu–O chain substructure. -- Abstract: We report on careful measurements of the temperature derivative of the resistivity, dρ/dT, in the region encompassing the superconducting transition of melt-textured samples of the YBa{sub 2}Cu{sub 3}O{sub 7−d} cuprate superconductor. Measurements were carried out in orientations parallel and perpendicular to the Cu − O{sub 2} atomic planes in the presence of small magnetic fields applied parallel to the current orientation. The dρ/dT results reveal the occurrence of complex multi-peak structures that were analyzed with a new method based on the assumption that a simple series association of conductivities is adequate for describing the resistive transition of multiphased superconductors. We ascribe the multi-peak structure observed in the derivative measurements to a subtle and complex phase separation phenomenon leading to the stabilization of domains having slightly different electronic properties that are related to the ordering of labile oxygen atoms in the YBa{sub 2}Cu{sub 3}O{sub 7−d} chain sub-structure.
Numerical model of melting, liquid migration and deformation during an ice cream meltdown test
Alvarez, G.; Warren, M.; Hartel, R.; Flick, D.
2016-01-01
4th IIR International Conference on Sustainability and the Cold Chain 2016 , Auckland, NZL, 07-/04/2016 - 09/04/2016; International audience; A numerical model was developed which describes the combined phenomena occurring during an ice cream meltdown test which is a test used by ice cream producers to estimate the quality of ice cream. It is based on the measurement of the drip loss and the deformation during melting of an ice cream block placed onto a grid at ambient temperature. This infor...
Microscopic model of the glass transition and the glassy state
International Nuclear Information System (INIS)
Shukla, P.
1982-07-01
A microscopic model of the glass transition and the glassy state is presented. It is exactly solvable, and offers a unified view of the equilibrium and non-equilibrium aspects of the glass transition. It also provides a statistical-mechanical justification of the irreversible thermodynamic models of the glass transition proposed earlier. (author)
Tian, Hao; Kuang, Xiao-Yu; Mao, Ai-Jie; Yang, Yurong; Xu, Changsong; Sayedaghaee, S. Omid; Bellaiche, L.
2018-01-01
High-melting-point oxides of chemical formula A B O3 with A =Ca , Sr, Ba and B =Zr , Hf are investigated as a function of hydrostatic pressure up to 200 GPa by combining first-principles calculations with a particle swarm optimization method. Ca- and Sr-based systems: (1) first undergo a reconstructive phase transition from a perovskite state to a novel structure that belongs to the post-post-perovskite family and (2) then experience an isostructural transition to a second, also new post-post-perovskite state at higher pressures, via the sudden formation of a specific out-of-plane B -O bond. In contrast, the studied Ba compounds evolve from a perovskite phase to a third novel post-post-perovskite structure via another reconstructive phase transition. The original characteristics of these three different post-post-perovskite states are emphasized. Unusual electronic properties, including significant piezochromic effects and an insulator-metal transition, are also reported and explained.
Modeling of air-droplet interaction, substrate melting and coating buildup in thermal spraying
Wei, Guanghua
Among the many surface coating techniques now available, thermal spray is known to offer the most advantages. It can meet a wide range of technical and engineering requirements in a relatively inexpensive and easily controllable way with the capability of producing repeatable results. In the last few decades a lot of important strides have been made in the field of measurements and modelling of thermal spraying. However, due to the complex of the process and the lack of basic materials-based knowledge about the particle melting, spreading and deposition, the relationship between the process parameters and the coating properties still remains unclear. In thermal spraying, a particle is melted to form a droplet with morphology and thermal- and kinetic-energy status change by the interaction with the plasma/flame. In order to produce higher-quality coatings and expand the use of this versatile family of technologies, modelling of the particle behaviors during in-flight, spreading and deposition is essential. This thesis investigates the connections between particle characteristics and coating properties. Momentum, heat and mass transfer phenomena related to particle in-flight, droplet impacting, spreading, and splat layering are studied. Numerical models are developed to establish the quantitative relationships between spray parameters, particle and substrate properties and deposition characteristics. Most existing theoretical studies of in-flight particle assume that the particle is in a spherical shape without voids inside. The behavior of porous particles in thermal spray has not been well understood. However, the presence of voids in the feedstock powders may have a great impact on particle in-flight behaviors such as particle acceleration, melting and oxidation because a hollowed particle is also lighter than a densed one and this will affect the particle trajectory. The particle shape also needs to be taken into account because it influences the drag force and
Directory of Open Access Journals (Sweden)
F. Holtz
2005-06-01
Full Text Available The effect of pressure, temperature, and melt composition on CO2 and H2O solubilities in aluminosilicate melts, coexisting with CO2-H2O fluids, is discussed on the basis of previously published and new experimental data. The datasets have been chosen so that CO2 and H2O are the main fluid components and the conclusions are only valid for relatively oxidizing conditions. The most important parameters controlling the solubilities of H2O and CO2 are pressure and composition of melt and fluid. On the other hand, the effect of temperature on volatile solubilities is relatively small. At pressures up to 200 MPa, intermediate compositions such as dacite, in which both molecular CO2 and carbonate species can be dissolved, show higher volatile solubilities than rhyolite and basalt. At higher pressures (0.5 to 1 GPa, basaltic melts can incorporate higher amounts of carbon dioxide (by a factor of 2 to 3 than rhyolitic and dacitic melts. Henrian behavior is observed only for CO2 solubility in equilibrium with H2O-CO2 fluids at pressures <100 MPa, whereas at higher pressures CO2 solubility varies nonlinearly with CO2 fugacity. The positive deviation from linearity with almost constant CO2 solubility at low water activity indicates that dissolved water strongly enhances the solubility of CO2. Water always shows non-Henrian solubility behavior because of its complex dissolution mechanism (incorporation of OH-groups and H2O molecules in the melt. The model of Newman and Lowenstern (2002, in which ideal mixing between volatiles in both fluid and melt phases is assumed, reproduces adequately the experimental data for rhyolitic and basaltic compositions at pressures below 200 MPa but shows noticeable disagreement at higher pressures, especially for basalt. The empirical model of Liu et al. (2004 is applicable to rhyolitic melts in a wide range of pressure (0-500 MPa and temperature (700- 1200°C but cannot be used for other melt compositions. The
Modelling transitions in urban water systems.
Rauch, W; Urich, C; Bach, P M; Rogers, B C; de Haan, F J; Brown, R R; Mair, M; McCarthy, D T; Kleidorfer, M; Sitzenfrei, R; Deletic, A
2017-12-01
Long term planning of urban water infrastructure requires acknowledgement that transitions in the water system are driven by changes in the urban environment, as well as societal dynamics. Inherent to the complexity of these underlying processes is that the dynamics of a system's evolution cannot be explained by linear cause-effect relationships and cannot be predicted under narrow sets of assumptions. Planning therefore needs to consider the functional behaviour and performance of integrated flexible infrastructure systems under a wide range of future conditions. This paper presents the first step towards a new generation of integrated planning tools that take such an exploratory planning approach. The spatially explicit model, denoted DAnCE4Water, integrates urban development patterns, water infrastructure changes and the dynamics of socio-institutional changes. While the individual components of the DAnCE4Water model (i.e. modules for simulation of urban development, societal dynamics and evolution/performance of water infrastructure) have been developed elsewhere, this paper presents their integration into a single model. We explain the modelling framework of DAnCE4Water, its potential utility and its software implementation. The integrated model is validated for the case study of an urban catchment located in Melbourne, Australia. Copyright © 2017 Elsevier Ltd. All rights reserved.
Spatio-temporal Variability of Albedo and its Impact on Glacier Melt Modelling
Kinnard, C.; Mendoza, C.; Abermann, J.; Petlicki, M.; MacDonell, S.; Urrutia, R.
2017-12-01
Albedo is an important variable for the surface energy balance of glaciers, yet its representation within distributed glacier mass-balance models is often greatly simplified. Here we study the spatio-temporal evolution of albedo on Glacier Universidad, central Chile (34°S, 70°W), using time-lapse terrestrial photography, and investigate its effect on the shortwave radiation balance and modelled melt rates. A 12 megapixel digital single-lens reflex camera was setup overlooking the glacier and programmed to take three daily images of the glacier during a two-year period (2012-2014). One image was chosen for each day with no cloud shading on the glacier. The RAW images were projected onto a 10m resolution digital elevation model (DEM), using the IMGRAFT software (Messerli and Grinsted, 2015). A six-parameter camera model was calibrated using a single image and a set of 17 ground control points (GCPs), yielding a georeferencing accuracy of accounting for possible camera movement over time. The reflectance values from the projected image were corrected for topographic and atmospheric influences using a parametric solar irradiation model, following a modified algorithm based on Corripio (2004), and then converted to albedo using reference albedo measurements from an on-glacier automatic weather station (AWS). The image-based albedo was found to compare well with independent albedo observations from a second AWS in the glacier accumulation area. Analysis of the albedo maps showed that the albedo is more spatially-variable than the incoming solar radiation, making albedo a more important factor of energy balance spatial variability. The incorporation of albedo maps within an enhanced temperature index melt model revealed that the spatio-temporal variability of albedo is an important factor for the calculation of glacier-wide meltwater fluxes.
Modeling Transit Patterns Via Mobile App Logs.
2016-01-01
Transit planners need detailed information of the trips people take using public transit in : order to design more optimal routes, address new construction projects, and address the : constantly changing needs of a city and metro region. Better trans...
Chen, Ting; Li, Liqing; Huang, Xiubao
2005-06-01
Physical, statistical and artificial neural network (ANN) models are established for predicting the fibre diameter of melt blown nonwovens from the processing parameters. The results show that the ANN model yields a very accurate prediction (average error of 0.013%), and a reasonably good ANN model can be achieved with relatively few data points. Because the physical model is based on the inherent physical principles of the phenomena of interest, it can yield reasonably good prediction results when experimental data are not available and the entire physical procedure is of interest. This area of research has great potential in the field of computer assisted design in melt blowing technology.
Modelling Hegemonic Power Transition in Cyberspace
Directory of Open Access Journals (Sweden)
Dmitry Brizhinev
2018-01-01
Full Text Available Cyberspace is the newest domain of conflict and cooperation between states. In cyberspace, as in all other domains, land, sea, air, and space, these interactions often lead to the emergence of hegemons which are characterised by their predominant influence over global world order and all other states. We examined the emergence and collapse of hegemons in a modelled cyberspace world through the notions of power transition and power diffusion. We used Repast Simphony to construct a simple agent-based model (ABM of a system of states interacting both competitively and cooperatively in this world. Our simple model parsimoniously captures the character of the real international system of states through simple parameters of wealth and power determining the outcome of attack or cooperation amongst pairwise interacting states. We found hegemons of global world order emerged in cyberspace as they do in the other traditional domains from models with these few parameters. And we found that hegemons, contrary to traditional understanding, are not exceptional states but merely occupy the tail of a continuous distribution of power and lifetimes. We also found that hegemony in the system depends on two perhaps unexpected parameters: the difficulty of acquiring power as wealth increases and the amount of cooperation between states. And as a consequence, we argue that cyberspace, as a power-diffuse domain where cooperation is easier than elsewhere, is less suited to the kind of hegemony we see in the traditional domains of state interaction.
3D modeling of continuous retreat of Thwaites Glacier, West Antarctica, under enhanced basal melting
Yu, H.; Rignot, E. J.; Seroussi, H. L.; Morlighem, M.
2017-12-01
Thwaites Glacier (TG) is the broadest and second largest ice stream in West Antarctica. Satellite observations have revealed rapid grounding line retreat and mass loss of TG in the past few decades, which has been attributed to enhanced ocean heat advection in the Amundsen Sea Embayment. As TG is resting on a retrograde bed, it has the potential to rapidly collapse according to the marine ice sheet instability theory. Here, we use the UCI/JPL Ice Sheet System Model (ISSM) to simulate the grounding line migration and mass loss of TG for the next 100 years in response to enhanced basal melting. Three models with varying levels of complexity (full-Stokes, higher-order and shallow-shelf approximation) are used and basal melt rate under ice shelf is parameterized as a function of depth. We show that the grounding line of TG will retreat rapidly along the eastern side of the glacier at a speed of 500-1000 m/yr while it will remain relatively stable on the western side due to the presence of a subglacial ridge. TG will continue to lose mass at a rapid rate (50-100 Gt/yr). If the grounding line retreats over this subglacial ridge, the retreat will become unstoppable. We also show that the full-Stokes model exhibits a higher rate of retreat than other models ( 10%). The difference is more significant when the grounding line is on a subglacial ridge, when full-Stokes can retreat over the ridge decades ahead of other models.This work has been performed at UC Irvine and Caltech's Jet Propulsion Laboratory under a contract with NASA's Cryospheric Science Program
Selection Bias in Educational Transition Models: Theory and Empirical Evidence
DEFF Research Database (Denmark)
Holm, Anders; Jæger, Mads
Most studies using Mare’s (1980, 1981) seminal model of educational transitions find that the effect of family background decreases across transitions. Recently, Cameron and Heckman (1998, 2001) have argued that the “waning coefficients” in the Mare model are driven by selection on unobserved...... the United States, United Kingdom, Denmark, and the Netherlands shows that when we take selection into account the effect of family background variables on educational transitions is largely constant across transitions. We also discuss several difficulties in estimating educational transition models which...
3D CFD computations of transitional flows using DES and a correlation based transition model
DEFF Research Database (Denmark)
Sørensen, Niels N.
The report describes the application of the correlation based transition model of of Menter et. al. [1, 2] to the cylinder drag crisis and the stalled flow over an DU-96-W-351 airfoil using the DES methodology. When predicting the flow over airfoils and rotors, the laminar-turbulent transition...... process can be important for the aerodynamic performance. Today, the most widespread approach is to use fully turbulent computations, where the transitional process is ignored and the entire boundary layer on the wings or airfoils is handled by the turbulence model. The correlation based transition model...
Mathematical and numerical modeling of melting in metal-ceramic composite beds
Mughal, Mohammad Pervez
2006-05-01
Many of the ceramics used in the manufacture of the metal-ceramic composites are available as powders, which has encouraged investigators to develop tool less manufacturing techniques. Innovative processes like combustion synthesis and laser sintering processes offer great potential for specific material combinations. These processes involve heat and mass transfer in porous matrix with melting, solidification and may be chemical reaction. Since the resulting transport is relatively complex, there are few mathematical models available. In the present study, melting and transport of metal is demonstrated for a one-dimensional bed with uniform heat generation and convectively cooled boundaries. The effects of different Bond, Biot and Prandtl numbers are discussed using constant and temperature varying material properties. At low bond number the transport is controlled by capillary forces and temperature and saturation distribution is symmetric about the center of the bed. For Biot number larger than ten the process is internally controlled. Effect of Prandtl number is opposite of that of the Bond number. Use of constant properties overpredicts the process rate by 13%.
CADASTER QSPR Models for Predictions of Melting and Boiling Points of Perfluorinated Chemicals.
Bhhatarai, Barun; Teetz, Wolfram; Liu, Tao; Öberg, Tomas; Jeliazkova, Nina; Kochev, Nikolay; Pukalov, Ognyan; Tetko, Igor V; Kovarich, Simona; Papa, Ester; Gramatica, Paola
2011-03-14
Quantitative structure property relationship (QSPR) studies on per- and polyfluorinated chemicals (PFCs) on melting point (MP) and boiling point (BP) are presented. The training and prediction chemicals used for developing and validating the models were selected from Syracuse PhysProp database and literatures. The available experimental data sets were split in two different ways: a) random selection on response value, and b) structural similarity verified by self-organizing-map (SOM), in order to propose reliable predictive models, developed only on the training sets and externally verified on the prediction sets. Individual linear and non-linear approaches based models developed by different CADASTER partners on 0D-2D Dragon descriptors, E-state descriptors and fragment based descriptors as well as consensus model and their predictions are presented. In addition, the predictive performance of the developed models was verified on a blind external validation set (EV-set) prepared using PERFORCE database on 15 MP and 25 BP data respectively. This database contains only long chain perfluoro-alkylated chemicals, particularly monitored by regulatory agencies like US-EPA and EU-REACH. QSPR models with internal and external validation on two different external prediction/validation sets and study of applicability-domain highlighting the robustness and high accuracy of the models are discussed. Finally, MPs for additional 303 PFCs and BPs for 271 PFCs were predicted for which experimental measurements are unknown. Copyright © 2011 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.
Lazeroms, Werner M. J.; Jenkins, Adrian; Hilmar Gudmundsson, G.; van de Wal, Roderik S. W.
2018-01-01
Basal melting below ice shelves is a major factor in mass loss from the Antarctic Ice Sheet, which can contribute significantly to possible future sea-level rise. Therefore, it is important to have an adequate description of the basal melt rates for use in ice-dynamical models. Most current ice models use rather simple parametrizations based on the local balance of heat between ice and ocean. In this work, however, we use a recently derived parametrization of the melt rates based on a buoyant meltwater plume travelling upward beneath an ice shelf. This plume parametrization combines a non-linear ocean temperature sensitivity with an inherent geometry dependence, which is mainly described by the grounding-line depth and the local slope of the ice-shelf base. For the first time, this type of parametrization is evaluated on a two-dimensional grid covering the entire Antarctic continent. In order to apply the essentially one-dimensional parametrization to realistic ice-shelf geometries, we present an algorithm that determines effective values for the grounding-line depth and basal slope in any point beneath an ice shelf. Furthermore, since detailed knowledge of temperatures and circulation patterns in the ice-shelf cavities is sparse or absent, we construct an effective ocean temperature field from observational data with the purpose of matching (area-averaged) melt rates from the model with observed present-day melt rates. Our results qualitatively replicate large-scale observed features in basal melt rates around Antarctica, not only in terms of average values, but also in terms of the spatial pattern, with high melt rates typically occurring near the grounding line. The plume parametrization and the effective temperature field presented here are therefore promising tools for future simulations of the Antarctic Ice Sheet requiring a more realistic oceanic forcing.
Safety models incorporating graph theory based transit indicators.
Quintero, Liliana; Sayed, Tarek; Wahba, Mohamed M
2013-01-01
There is a considerable need for tools to enable the evaluation of the safety of transit networks at the planning stage. One interesting approach for the planning of public transportation systems is the study of networks. Network techniques involve the analysis of systems by viewing them as a graph composed of a set of vertices (nodes) and edges (links). Once the transport system is visualized as a graph, various network properties can be evaluated based on the relationships between the network elements. Several indicators can be calculated including connectivity, coverage, directness and complexity, among others. The main objective of this study is to investigate the relationship between network-based transit indicators and safety. The study develops macro-level collision prediction models that explicitly incorporate transit physical and operational elements and transit network indicators as explanatory variables. Several macro-level (zonal) collision prediction models were developed using a generalized linear regression technique, assuming a negative binomial error structure. The models were grouped into four main themes: transit infrastructure, transit network topology, transit route design, and transit performance and operations. The safety models showed that collisions were significantly associated with transit network properties such as: connectivity, coverage, overlapping degree and the Local Index of Transit Availability. As well, the models showed a significant relationship between collisions and some transit physical and operational attributes such as the number of routes, frequency of routes, bus density, length of bus and 3+ priority lanes. Copyright © 2012 Elsevier Ltd. All rights reserved.
Liquid-liquid phase transition and glass transition in a monoatomic model system.
Xu, Limei; Buldyrev, Sergey V; Giovambattista, Nicolas; Stanley, H Eugene
2010-01-01
We review our recent study on the polyamorphism of the liquid and glass states in a monatomic system, a two-scale spherical-symmetric Jagla model with both attractive and repulsive interactions. This potential with a parametrization for which crystallization can be avoided and both the glass transition and the liquid-liquid phase transition are clearly separated, displays water-like anomalies as well as polyamorphism in both liquid and glassy states, providing a unique opportunity to study the interplay between the liquid-liquid phase transition and the glass transition. Our study on a simple model may be useful in understanding recent studies of polyamorphism in metallic glasses.
Cai, C.; Rignot, E. J.; Menemenlis, D.; Millan, R.; Bjørk, A. A.; Khan, S. A.; Charolais, A.
2017-12-01
Zachariæ Isstrøm, a major ice stream in northeast Greenland, lost a large fraction of its ice shelf during the last decade. We study the evolution of subaqueous melting of its floating section from 1978 to present. The ice shelf melt rate depends on thermal forcing from warm, salty, subsurface ocean waters of Atlantic origin (AW), the mixing of AW with fresh, buoyant subglacial discharge at the calving margin, and the shape of the sub-ice-shelf cavity. Subglacial discharge doubled as a result of enhanced ice sheet runoff caused by warmer air temperatures. Ocean thermal forcing has increased due to enhanced advection of AW. Using an Eulerian method, MEaSUREs ice velocity, Operation IceBridge (OIB) ice thickness, and RACMO2.3 surface balance data, we evaluate the ice shelf melt rate in 1978, 1999 and 2010. The melt rate doubled from 1999 to 2010. Using a Lagrangian method with World View imagery, we map the melt rate in detail from 2011 to 2016. We compare the results with 2D simulations from the Massachusetts Institute of Technology general circulation model (MITgcm), at a high spatial resolution (20-m horizontal and 40-m vertical grid spacing), using OIB ice thickness and sub-ice-shelf cavity for years 1978, 1996, 2010 and 2011, combined with in-situ ocean temperature/salinity data from Ocean Melting Greenland (OMG) 2017. We find that winter melt rates are 2 3 times smaller than summer rates and melt rates increase by one order magnitude during the transition from ice shelf termination to near-vertical calving wall termination. As the last remaining bits of floating ice shelf disappear, ice-ocean interaction will therefore play an increasing role in driving the glacier retreat into its marine-based basin. This work was performed under a contract with NASA Cryosphere Program at UC Irvine and Caltech's Jet Propulsion Laboratory.
Transitioning Back to Mainstream Education: The Flexible Integration Model
Cumming, Therese M.; Strnadová, Iva
2017-01-01
The implementation of a transition model, the flexible integration model, was investigated in a school in Sydney, Australia, using an exploratory single case study design (Rowley, 2002). It is a person-centred model designed to assist students in transitioning from a special school for students with emotional and behavioural disabilities to…
DEFF Research Database (Denmark)
Hattel, Jesper Henri; Pryds, Nini
2006-01-01
In this paper, the relationship between the Gas to Melt Ratio (GMR) and the solid fraction of an evolving billet surface is investigated numerically. The basis for the analysis is a recently developed integrated procedure for modelling the entire spray forming process. This model includes the ato...
Point, surface and volumetric heat sources in the thermal modelling of selective laser melting
Yang, Yabin; Ayas, Can
2017-10-01
Selective laser melting (SLM) is a powder based additive manufacturing technique suitable for producing high precision metal parts. However, distortions and residual stresses within products arise during SLM because of the high temperature gradients created by the laser heating. Residual stresses limit the load resistance of the product and may even lead to fracture during the built process. It is therefore of paramount importance to predict the level of part distortion and residual stress as a function of SLM process parameters which requires a reliable thermal modelling of the SLM process. Consequently, a key question arises which is how to describe the laser source appropriately. Reasonable simplification of the laser representation is crucial for the computational efficiency of the thermal model of the SLM process. In this paper, first a semi-analytical thermal modelling approach is described. Subsequently, the laser heating is modelled using point, surface and volumetric sources, in order to compare the influence of different laser source geometries on the thermal history prediction of the thermal model. The present work provides guidelines on appropriate representation of the laser source in the thermal modelling of the SLM process.
2008-06-01
la transition, la croissance des instabilités 3D et leurs mécanismes d’éclatement, les progrès effectués dans les méthodes Navier Stoke parabolisées...EN-AVT-151 Advances in Laminar Turbulent Transition Modelling (Les avancées dans la modélisation de la transition laminaire turbulente) Papers...
Directory of Open Access Journals (Sweden)
G. Martelloni
2013-03-01
Full Text Available We propose a simple snow accumulation/melting model (SAMM to be applied at regional scale in conjunction with landslide warning systems based on empirical rainfall thresholds. SAMM is based on two modules modelling the snow accumulation and the snowmelt processes. Each module is composed by two equations: a conservation of mass equation is solved to model snowpack thickness and an empirical equation for the snow density. The model depends on 13 empirical parameters, whose optimal values were defined with an optimisation algorithm (simplex flexible using calibration measures of snowpack thickness. From an operational point of view, SAMM uses as input data only temperature and rainfall measurements, bringing about the additional benefit of a relatively easy implementation. After performing a cross validation and a comparison with two simpler temperature index models, we simulated an operational employment in a regional scale landslide early warning system (EWS and we found that the EWS forecasting effectiveness was substantially improved when used in conjunction with SAMM.
THE SEMIEMPIRICAL MODEL OF THE MULTICOMPONENT BUBBLE BEHAVIOUR IN GLASS MELTS
Directory of Open Access Journals (Sweden)
LUBOMÍR NĚMEC
2012-12-01
Full Text Available A semi-empirical model of the bubble growth and dissolution in glasses with a fining agent has been derived. This model applies the experimental data from bubble observation at melting and fining temperatures. The experimental data needed for the model involved the temperature dependences of the average growth rate of the bubble radius and the average concentration of the fining gas in the bubbles. Both sets of values were measured in the laboratory in the glass of the float type and applied in the model. The measurements of the solubilities and diffusion coefficients of the gases present in the glass – needed for the analytical model of multicomponent bubbles – were thus avoided. The course of the partial bubble absorption with the temperature decreasing was simulated by means of two factors modifying the experimental values of the bubble growth rates at constant temperature. The temperature dependence of the resulting bubble growth rate qualitatively corresponded to the experimental observations in the soda-lime-silica glass, but a more detailed experimental and comparative study has yet to be performed. Such a study is being prepared.
Predicting the enthalpies of melting and vaporization for pure components
Esina, Z. N.; Korchuganova, M. R.
2014-12-01
A mathematical model of the melting and vaporization enthalpies of organic components based on the theory of thermodynamic similarity is proposed. In this empirical model, the phase transition enthalpy for the homological series of n-alkanes, carboxylic acids, n-alcohols, glycols, and glycol ethers is presented as a function of the molecular mass, the number of carbon atoms in a molecule, and the normal transition temperature. The model also uses a critical or triple point temperature. It is shown that the results from predicting the melting and vaporization enthalpies enable the calculation of binary phase diagrams.
Directory of Open Access Journals (Sweden)
A. H. MacDougall
2011-11-01
Full Text Available Efforts to project the long-term melt of mountain glaciers and ice-caps require that melt models developed and calibrated for well studied locations be transferable over large regions. Here we assess the sensitivity and transferability of parameters within several commonly used melt models for two proximal sites in a dry subarctic environment of northwestern Canada. The models range in complexity from a classical degree-day model to a simplified energy-balance model. Parameter sensitivity is first evaluated by tuning the melt models to the output of an energy balance model forced with idealized inputs. This exercise allows us to explore parameter sensitivity both to glacier geometric attributes and surface characteristics, as well as to meteorological conditions. We then investigate the effect of model tuning with different statistics, including a weighted coefficient of determination (wR^{2}, the Nash-Sutcliffe efficiency criterion (E, mean absolute error (MAE and root mean squared error (RMSE. Finally we examine model parameter transferability between two neighbouring glaciers over two melt seasons using mass balance data collected in the St. Elias Mountains of the southwest Yukon. The temperature-index model parameters appear generally sensitive to glacier aspect, mean surface elevation, albedo, wind speed, mean annual temperature and temperature lapse rate. The simplified energy balance model parameters are sensitive primarily to snow albedo. Model tuning with E, MAE and RMSE produces similar, or in some cases identical, parameter values. In twelve tests of spatial and/or temporal parameter transferability, the results with the lowest RMSE values with respect to ablation stake measurements were achieved twice with a classical temperature-index (degree-day model, three times with a temperature-index model in which the melt parameter is a function of potential radiation, and seven times with a simplified energy
Brodzik, M. J.; Armstrong, R. L.; Khalsa, S. J. S.; Painter, T. H.; Racoviteanu, A.; Rittger, K.
2014-12-01
Ice melt from mountain glaciers can represent a significant contribution to freshwater hydrological budgets, along with seasonal snow melt, rainfall and groundwater. In the rivers of High Asia, understanding the proportion of glacier ice melt is critical for water resource management of irrigation and planning for hydropower generation and human consumption. Current climate conditions are producing heterogeneous glacier responses across the Hindu Kush-Karakoram-Himalayan ranges. However, it is not yet clear how contrasting glacier patterns affect regional water resources. For example, in the Upper Indus basin, estimates of glacial contribution to runoff are often not distinguished from seasonal snow contribution, and vary widely, from as little as 15% to as much as 55%. While many studies are based on reasonable concepts, most are based on assumptions uninformed by actual snow or ice cover measurements. While straightforward temperature index models have been used to estimate glacier runoff in some Himalayan basins, application of these models in larger Himalayan basins is limited by difficulties in estimating key model parameters, particularly air temperature. Estimating glacial area from the MODIS Permanent Snow and Ice Extent (MODICE) product for the years 2000-2013, with recently released Shuttle Radar Topography Mission (SRTMGL3) elevation data, we use a simple ablation gradient approach to calculate an upper limit on the contribution of clean glacier ice melt to streamflow data. We present model results for the five major rivers with glaciated headwaters in High Asia: the Bramaputra, Ganges, Indus, Amu Darya and Syr Darya. Using GRDC historical discharge records, we characterize the annual contribution from glacier ice melt. We use MODICE interannual trends in each basin to estimate glacier ice melt uncertainties. Our results are being used in the USAID project, Contribution to High Asia Runoff from Ice and Snow (CHARIS), to inform regional-scale planning for
Implementation of a thermomechanical model for the simulation of selective laser melting
Energy Technology Data Exchange (ETDEWEB)
Hodge, N. E. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Ferencz, R. M. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Solberg, J. M. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)
2014-07-01
Selective laser melting (SLM) is an additive manufacturing process in which multiple, successive layers of metal powders are heated via laser in order to build a part. Modeling of SLM requires consideration of both heat transfer and solid mechanics. The present work describes continuum modeling of SLM as envisioned for eventual support of part-scale modeling of this fabrication process to determine end-state information such as residual stresses and distortion. The determination of the evolving temperatures is dependent on the material, the state of the material (powder or solid), the specified heating, and the configuration. Similarly, the current configuration is dependent on the temperatures, the powder-solid state, and the constitutive models. A multi-physics numerical formulation is required to solve such problems. This article describes the problem formulation, numerical method, and constitutive parameters necessary to solve such a problem. Additionally, various verification and example problems are simulated in the parallel, multi-physics finite element code Diablo, and the results presented herein.
Convergence of Transition Probability Matrix in CLVMarkov Models
Permana, D.; Pasaribu, U. S.; Indratno, S. W.; Suprayogi, S.
2018-04-01
A transition probability matrix is an arrangement of transition probability from one states to another in a Markov chain model (MCM). One of interesting study on the MCM is its behavior for a long time in the future. The behavior is derived from one property of transition probabilty matrix for n steps. This term is called the convergence of the n-step transition matrix for n move to infinity. Mathematically, the convergence of the transition probability matrix is finding the limit of the transition matrix which is powered by n where n moves to infinity. The convergence form of the transition probability matrix is very interesting as it will bring the matrix to its stationary form. This form is useful for predicting the probability of transitions between states in the future. The method usually used to find the convergence of transition probability matrix is through the process of limiting the distribution. In this paper, the convergence of the transition probability matrix is searched using a simple concept of linear algebra that is by diagonalizing the matrix.This method has a higher level of complexity because it has to perform the process of diagonalization in its matrix. But this way has the advantage of obtaining a common form of power n of the transition probability matrix. This form is useful to see transition matrix before stationary. For example cases are taken from CLV model using MCM called Model of CLV-Markov. There are several models taken by its transition probability matrix to find its convergence form. The result is that the convergence of the matrix of transition probability through diagonalization has similarity with convergence with commonly used distribution of probability limiting method.
Thermodynamic model of nonequilibrium phase transitions.
Martyushev, L M; Konovalov, M S
2011-07-01
Within the scope of a thermodynamic description using the maximum entropy production principle, transitions from one nonequilibrium (kinetic) regime to another are considered. It is shown that in the case when power-law dependencies of thermodynamic flux on force are similar for two regimes, only a transition accompanied by a positive jump of thermodynamic flux is possible between them. It is found that the difference in powers of the dependencies of thermodynamic fluxes on forces results in a number of interesting nonequilibrium transitions between kinetic regimes, including the reentrant one with a negative jump of thermodynamic flux.
Modelling the evaporation of boron species. Part 1: Alkali-free borosilicate glass melts
Limpt, J.A.C. van; Beerkens, R.G.C.; Cook, S.; O'Connor, R.; Simon, J.
2011-01-01
A laboratory test facility has been used to measure the boron evaporation rates from borosilicate glass melts. The impact of furnace atmosphere composition and glass melt composition on the temperature dependent boron evaporation rates has been investigated experimentally. In Part 1 of this paper
Ayala, Alvaro; Pellicciotti, Francesca; MacDonell, Shelley; McPhee, James; Burlando, Paolo
2015-04-01
Empirical melt (EM) models are often preferred to surface energy balance (SEB) models to calculate melt amounts of snow and ice in hydrological modelling of high-elevation catchments. The most common reasons to support this decision are that, in comparison to SEB models, EM models require lower levels of meteorological data, complexity and computational costs. However, EM models assume that melt can be characterized by means of a few index variables only, and their results strongly depend on the transferability in space and time of the calibrated empirical parameters. In addition, they are intrinsically limited in accounting for specific process components, the complexity of which cannot be easily reconciled with the empirical nature of the model. As an example of an EM model, in this study we use the Enhanced Temperature Index (ETI) model, which calculates melt amounts using air temperature and the shortwave radiation balance as index variables. We evaluate the performance of the ETI model on dry high-elevation sites where sublimation amounts - that are not explicitly accounted for the EM model - represent a relevant percentage of total ablation (1.1 to 8.7%). We analyse a data set of four Automatic Weather Stations (AWS), which were collected during the ablation season 2013-14, at elevations between 3466 and 4775 m asl, on the glaciers El Tapado, San Francisco, Bello and El Yeso, which are located in the semiarid Andes of central Chile. We complement our analysis using data from past studies in Juncal Norte Glacier (Chile) and Haut Glacier d'Arolla (Switzerland), during the ablation seasons 2008-09 and 2006, respectively. We use the results of a SEB model, applied to each study site, along the entire season, to calibrate the ETI model. The ETI model was not designed to calculate sublimation amounts, however, results show that their ability is low also to simulate melt amounts at sites where sublimation represents larger percentages of total ablation. In fact, we
International Nuclear Information System (INIS)
De Focatiis, Davide S. A.; Buckley, C. Paul; Embery, John
2008-01-01
This paper investigates the behaviour of a well-characterised monodisperse grade of entangled atactic polystyrene across a very wide temperature and strain rate range through linear and non-linear melt rheology and solid-state deformation. In an effort to construct a constitutive model for large deformations able to describe rheological response right across this wide timescale, two well-established rheological models are combined: the well known RoliePoly (RP) conformational melt model and the Oxford glass-rubber constitutive model for glassy polymers. Comparisons between experimental data and simulations from a numerical implementation of the model illustrate that the model can cope well with the range of deformations in which orientation is limited to length-scales longer than an entanglement length. One approach in which the model can be expanded to incorporate the effects of orientation on shorter length scales using anisotropic viscoplastic flow is briefly discussed
Model for pairing phase transition in atomic nuclei
International Nuclear Information System (INIS)
Schiller, A.; Guttormsen, M.; Hjorth-Jensen, M.; Rekstad, J.; Siem, S.
2002-01-01
A model is developed which allows the investigation and classification of the pairing phase transition in atomic nuclei. The regions of the parameter space are discussed for which a pairing phase transition can be observed. The model parameters include number of particles, attenuation of pairing correlations with increasing seniority, single-particle level spacing, and pairing gap parameter
International Nuclear Information System (INIS)
Gonzalez, M.T.; Vina, J.; Curras, S.R.; Veira, J.A.; Maza, J.; Vidal, F.
2004-01-01
Current-voltage characteristics (CVCs), up to current densities several times the critical current density J c , are presented for melt-textured samples and films of YBa 2 Cu 3 O 7-δ , at various temperatures. The results for both kind of samples present an overall common behavior: above J c , electric field E increases with current density J in a non-linear but smooth way, up to a particular point (J*,E*), at which an abrupt transition to a highly dissipative regime takes place. The only significant difference between the two set of curves is that both E and J along the CVCs are two order of magnitude higher in films, this including E* and J*. From the analysis of the data, a parallel variation of the electric field with current, and a common value of the ratio J*/J c has been found in both CVCs sets. These results suggest a common origin of the abrupt transition in both kind of samples, in spite of the scaling difference in E and J
Understanding & modeling bus transit driver availability.
2014-07-01
Bus transit agencies are required to hire extraboard (i.e. back-up) operators to account for unexpected absences. Incorrect sizing of extra driver workforce is problematic for a number of reasons. Overestimating the appropriate number of extraboard o...
Thermo-hydrodynamic and inductive modelling of a glass melt elaborated in cold inductive crucible
International Nuclear Information System (INIS)
Sauvage, E.
2009-11-01
Within the context of a search for a new vitrification process for nuclear wastes with a replacement of the presently used metallic pot by an inductive cold crucible, this research thesis deals with the numerical modelling of this technology. After having recalled the interest of nuclear waste vitrification, this report presents the new process based on the use of a cold crucible, describing principles and objectives of this method, and the characteristic physical phenomena associated with the flow and the thermodynamics of the glassy melt in such a crucible. It also recalls and comments the existing works on modelling. The main objective of this research is then to demonstrate the feasibility of 3D thermo-hydraulic and inductive simulations. He describes and analyses the glass physical properties (electrical properties, viscosity, thermal properties), the electromagnetic, hydrodynamic and thermal phenomena. He presents in detail the bubbling mixing modelling, reports 3D induction and fluid mechanical coupling calculations, and specific thermal investigations (radiating transfers, thermal limit conditions)
Meier, D.; Lukin, G.; Thieme, N.; Bönisch, P.; Dadzis, K.; Büttner, L.; Pätzold, O.; Czarske, J.; Stelter, M.
2017-03-01
This paper describes novel equipment for model experiments designed for detailed studies on electromagnetically driven flows as well as solidification and melting processes with low-melting metals in a square-based container. Such model experiments are relevant for a validation of numerical flow simulation, in particular in the field of directional solidification of multi-crystalline photovoltaic silicon ingots. The equipment includes two square-shaped electromagnetic coils and a melt container with a base of 220×220 mm2 and thermostat-controlled heat exchangers at top and bottom. A system for dual-plane, spatial- and time-resolved flow measurements as well as for in-situ tracking of the solid-liquid interface is developed on the basis of the ultrasound Doppler velocimetry. The parameters of the model experiment are chosen to meet the scaling laws for a transfer of experimental results to real silicon growth processes. The eutectic GaInSn alloy and elemental gallium with melting points of 10.5 °C and 29.8 °C, respectively, are used as model substances. Results of experiments for testing the equipment are presented and discussed.
MELT-IIIB: an updated version of the melt code
International Nuclear Information System (INIS)
Tabb, K.K.; Lewis, C.H.; O'Dell, L.D.; Padilla, A. Jr.; Smith, D.E.; Wilburn, N.P.
1979-04-01
The MELT series is a reactor modeling code designed to investigate a wide variety of hypothetical accident conditions, particularly the transient overpower sequence. MELT-IIIB is the latest in the series
Basch, Valentin; Rampone, Elisabetta; Ildefonse, Benoit; Godard, Marguerite; Crispini, Laura
2017-04-01
rather constant Forsterite content in olivine, and significant Zr, Ti, HREE heterogeneity in olivine, systematically correlated with the textural variability (e.g. corroded deformed vs. undeformed granular olivine). These features indicate that reactive crystallization had an important role in the origin of the ET troctolites. We infer that the textural heterogeneity of olivine in the troctolite B is related to variations in the degree of undercooling and cooling rate of the melt (Faure et al, 2003). The skeletal olivine crystallization could correspond to the influx of a more primitive melt into a colder host troctolite, followed by evolution of the melt leading to formation of fine-grained euhedral crystals. Overall, the results of this study suggest a poly-phase formation of this hectometre-scale gabbroic body, involving impregnation of a mantle-derived dunitic body followed by intrusion of undercooled primitive melts. Faure, F., Trolliard, G., Nicollet, C. & Montel, J.M. (2003), A developmental model of olivine morphology as a function of the cooling rate and the degree of undercooling. Contrib. Miner. Petrol. 145:251-263.
Asimow, P. D.; Akin, M. C.; Homel, M.; Crum, R. S.; Pagan, D.; Lind, J.; Bernier, J.; Mosenfelder, J. L.; Dillman, A. M.; Lavina, B.; Lee, S.; Fat'yanov, O. V.; Newman, M. G.
2017-06-01
The phase transitions of forsterite under shock were studied by x-ray diffraction and pyrometry. Samples of 2 mm thick, near-full density (>98% TMD) polycrystalline forsterite were characterized by EBSD and computed tomography and shock compressed to 50 and 75 GPa by two-stage gas gun at the Dynamic Compression Sector, Advanced Photon Source, with diffraction imaged during compression and release. Changes in diffraction confirm a phase transition by 75 GPa. In parallel, single-crystal forsterite shock temperatures were taken from 120 to 210 GPa with improved absolute calibration procedures on the Caltech 6-channel pyrometer and two-stage gun and used to examine the interpretation of superheating and P-T slope of the liquid Hugoniot. This work performed under the auspices of the U.S. Department of Energy (DOE) by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344, supported in part by LLNL's LDRD program under Grants 15-ERD-012 and 16-ERD-010. The Dynamic Compression Sector (35) is supported by DOE / National Nuclear Security Administration under Award Number DE-NA0002442. This research used resources of the Advanced Photon Source, a U.S. DOE Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. Caltech lab supported by NSF EAR-1426526.
Passalacqua, Olivier; Ritz, Catherine; Parrenin, Frédéric; Urbini, Stefano; Frezzotti, Massimo
2017-09-01
Basal melt rate is the most important physical quantity to be evaluated when looking for an old-ice drilling site, and it depends to a great extent on the geothermal flux (GF), which is poorly known under the East Antarctic ice sheet. Given that wet bedrock has higher reflectivity than dry bedrock, the wetness of the ice-bed interface can be assessed using radar echoes from the bedrock. But, since basal conditions depend on heat transfer forced by climate but lagged by the thick ice, the basal ice may currently be frozen whereas in the past it was generally melting. For that reason, the risk of bias between present and past conditions has to be evaluated. The objective of this study is to assess which locations in the Dome C area could have been protected from basal melting at any time in the past, which requires evaluating GF. We used an inverse approach to retrieve GF from radar-inferred distribution of wet and dry beds. A 1-D heat model is run over the last 800 ka to constrain the value of GF by assessing a critical ice thickness, i.e. the minimum ice thickness that would allow the present local distribution of basal melting. A regional map of the GF was then inferred over a 80 km × 130 km area, with a N-S gradient and with values ranging from 48 to 60 mW m-2. The forward model was then emulated by a polynomial function to compute a time-averaged value of the spatially variable basal melt rate over the region. Three main subregions appear to be free of basal melting, two because of a thin overlying ice and one, north of Dome C, because of a low GF.
Directory of Open Access Journals (Sweden)
O. Passalacqua
2017-09-01
Full Text Available Basal melt rate is the most important physical quantity to be evaluated when looking for an old-ice drilling site, and it depends to a great extent on the geothermal flux (GF, which is poorly known under the East Antarctic ice sheet. Given that wet bedrock has higher reflectivity than dry bedrock, the wetness of the ice–bed interface can be assessed using radar echoes from the bedrock. But, since basal conditions depend on heat transfer forced by climate but lagged by the thick ice, the basal ice may currently be frozen whereas in the past it was generally melting. For that reason, the risk of bias between present and past conditions has to be evaluated. The objective of this study is to assess which locations in the Dome C area could have been protected from basal melting at any time in the past, which requires evaluating GF. We used an inverse approach to retrieve GF from radar-inferred distribution of wet and dry beds. A 1-D heat model is run over the last 800 ka to constrain the value of GF by assessing a critical ice thickness, i.e. the minimum ice thickness that would allow the present local distribution of basal melting. A regional map of the GF was then inferred over a 80 km × 130 km area, with a N–S gradient and with values ranging from 48 to 60 mW m−2. The forward model was then emulated by a polynomial function to compute a time-averaged value of the spatially variable basal melt rate over the region. Three main subregions appear to be free of basal melting, two because of a thin overlying ice and one, north of Dome C, because of a low GF.
Keller, Tobias; Katz, Richard F.
2015-04-01
Laboratory experiments indicate that even small concentrations volatiles (H2O or CO2) in the upper mantle significantly affect the silicate melting behavior [HK96,DH06]. The presence of volatiles stabilizes volatile-rich melt at high pressure, thus vastly increasing the volume of the upper mantle expected to be partially molten [H10,DH10]. These small-degree melts have important consequences for chemical differentiation and could affect the dynamics of mantle flow. We have developed theory and numerical implementation to simulate thermo-chemically coupled magma/mantle dynamics in terms of a two-phase (rock+melt), three component (dunite+MORB+volatilized MORB) physical model. The fluid dynamics is based on McKenzie's equations [McK84], while the thermo-chemical formulation of the system is represented by a novel disequilibrium multi-component melting model based on thermo-dynamic theory [RBS11]. This physical model is implemented as a parallel, two-dimensional, finite-volume code that leverages tools from the PETSc toolkit. Application of this simulation code to a mid-ocean ridge system suggests that the methodology captures the leading-order features of both hydrated and carbonated mantle melting, including deep, low-degree, volatile-rich melt formation. Melt segregation leads to continuous dynamic thermo-chemical dis-equilibration, while phenomenological reaction rates are applied to continually move the system towards re-equilibration. The simulations will be used first to characterize volatile extraction from the MOR system assuming a chemically homogeneous mantle. Subsequently, simulations will be extended to investigate the consequences of heterogeneity in lithology [KW12] and volatile content. These studies will advance our understanding of the role of volatiles in the dynamic and chemical evolution of the upper mantle. Moreover, they will help to gauge the significance of the coupling between the deep carbon cycle and the ocean/atmosphere system. REFERENCES
Bochmann, Esther S; Neumann, Dirk; Gryczke, Andreas; Wagner, Karl G
2016-10-01
A new predictive micro-scale solubility and process model for amorphous solid dispersions (ASDs) by hot-melt extrusion (HME) is presented. It is based on DSC measurements consisting of an annealing step and a subsequent analysis of the glass transition temperature (Tg). The application of a complex mathematical model (BCKV-equation) to describe the dependency of Tg on the active pharmaceutical ingredient (API)/polymer ratio, enables the prediction of API solubility at ambient conditions (25°C). Furthermore, estimation of the minimal processing temperature for forming ASDs during HME trials could be defined and was additionally confirmed by X-ray powder diffraction data. The suitability of the DSC method was confirmed with melt rheological trials (small amplitude oscillatory system). As an example, ball milled physical mixtures of dipyridamole, indomethacin, itraconazole and nifedipine in poly(vinylpyrrolidone-co-vinylacetate) (copovidone) and polyvinyl caprolactam-polyvinyl acetate-polyethylene glycol graft copolymer (Soluplus®) were used. Copyright © 2016 Elsevier B.V. All rights reserved.
Bertoldi, Dalía S.; Millán, Emmanuel N.; Guillermet, Armando Fernández
2017-12-01
The paper presents a thermodynamic study of the melting transition in Au nano-clusters with a number of atoms (N) in the range 103 means of a formalism involving an isomerization-type reaction between the atoms in the SPL and the LPL is explored. To this aim, an equilibrium constant (Keq) involving the concentration of such types of atoms is introduced. Finally, it is shown that a thermodynamic, van't Hoff analysis of the size-dependence of Keq yields values of the T0 temperature which are in very good agreement with those obtained from the energy and entropy values.
Dendritic solidification in undercooled Ni-Zr-Al melts: Experiments and modeling
Energy Technology Data Exchange (ETDEWEB)
Galenko, P.K., E-mail: Peter.Galenko@dlr.de [Institut fuer Materialsphysik im Weltraum, Deutsches Zentrum fuer Luft- und Raumfahrt (DLR), D-51170 Koeln (Germany); Reutzel, S.; Herlach, D.M. [Institut fuer Materialsphysik im Weltraum, Deutsches Zentrum fuer Luft- und Raumfahrt (DLR), D-51170 Koeln (Germany); Fries, S.G. [ICAMS, Ruhr-Universitaet Bochum, Stiepeler Strasse 129, D-44780 Bochum (Germany)] [SGF Scientific Consultancy, Arndtstr 9, D-52064 Aachen (Germany); Steinbach, I. [ICAMS, Ruhr-Universitaet Bochum, Stiepeler Strasse 129, D-44780 Bochum (Germany); Apel, M. [ACCESS eV, Intzestrasse 5, D-52072 Aachen (Germany)
2009-12-15
The kinetics of dendritic solidification in a ternary Ni{sub 98}Zr{sub 1}Al{sub 1} alloy is investigated experimentally in a range of melt undercoolings 40K{<=}{Delta}T{<=}320K. The growth velocity is measured for samples processed by the electromagnetic levitation technique using a high-speed video camera. With {Delta}T{<=}220K the measured growth rates are the same as those of a binary Ni{sub 99}Zr{sub 1} alloy. In the regime of rapid solidification, especially within the regime of thermal dendritic growth at {Delta}T{>=}220K, growth rates are decreased. Sharp-interface modeling predicts growth rates over the whole range of undercooling. Phase-field simulations give quantitative predictions for the dendritic growth velocity in the solute-controlled growth regime. Results show that the composition and temperature dependency of the thermodynamic data, e.g. liquidus slope and solute partition coefficient, are important for describing the alloys. Our findings give improved sharp-interface model predictions compared to calculations based on an approximation of the thermodynamic data derived from binary phase diagrams.
Birdsell, Dawn N; Pearson, Talima; Price, Erin P; Hornstra, Heidie M; Nera, Roxanne D; Stone, Nathan; Gruendike, Jeffrey; Kaufman, Emily L; Pettus, Amanda H; Hurbon, Audriana N; Buchhagen, Jordan L; Harms, N Jane; Chanturia, Gvantsa; Gyuranecz, Miklos; Wagner, David M; Keim, Paul S
2012-01-01
Single nucleotide polymorphisms (SNPs) are abundant in genomes of all species and biologically informative markers extensively used across broad scientific disciplines. Newly identified SNP markers are publicly available at an ever-increasing rate due to advancements in sequencing technologies. Efficient, cost-effective SNP genotyping methods to screen sample populations are in great demand in well-equipped laboratories, but also in developing world situations. Dual Probe TaqMan assays are robust but can be cost-prohibitive and require specialized equipment. The Mismatch Amplification Mutation Assay, coupled with melt analysis (Melt-MAMA), is flexible, efficient and cost-effective. However, Melt-MAMA traditionally suffers from high rates of assay design failures and knowledge gaps on assay robustness and sensitivity. In this study, we identified strategies that improved the success of Melt-MAMA. We examined the performance of 185 Melt-MAMAs across eight different pathogens using various optimization parameters. We evaluated the effects of genome size and %GC content on assay development. When used collectively, specific strategies markedly improved the rate of successful assays at the first design attempt from ~50% to ~80%. We observed that Melt-MAMA accurately genotypes across a broad DNA range (~100 ng to ~0.1 pg). Genomic size and %GC content influence the rate of successful assay design in an independent manner. Finally, we demonstrated the versatility of these assays by the creation of a duplex Melt-MAMA real-time PCR (two SNPs) and conversion to a size-based genotyping system, which uses agarose gel electrophoresis. Melt-MAMA is comparable to Dual Probe TaqMan assays in terms of design success rate and accuracy. Although sensitivity is less robust than Dual Probe TaqMan assays, Melt-MAMA is superior in terms of cost-effectiveness, speed of development and versatility. We detail the parameters most important for the successful application of Melt-MAMA, which
Directory of Open Access Journals (Sweden)
Singh U.C.
2013-01-01
Full Text Available In a theoretical analysis, a lump-integral model for freezing and melting of the bath material onto a cylindrical additive having its thermal resistance negligible with respect to that of the bath is developed. It is regulated by independent nondimensional parameters, namely the Stefan number, St the heat capacity ratio, Cr and the modified conduction factor, Cofm. Series solutions associated with short times for time variant growth of the frozen layer and rise in interface temperature between the additive and the frozen layer are obtained. For all times, numerical solutions concerning the frozen layer growth with its melting and increase in the interface temperature are also found. Time for freezing and melting is estimated for different values of Cr, St and Cofm. It is predicted that for lower total time of freezing and melting Cofm<2 or Cr<1 needs to be maintained. When the bath temperature equals the freezing temperature of the bath material, the model is governed by only Cr and St and gives closed-form expressions for the growth of the frozen layer and the interface temperature. For the interface attaining the freezing temperature of the bath material the maximum thickness of the frozen layer becomes ξmax-√Cr(Cr+St. The model is validated once it is reduced to a problem of heating of the additive without freezing of the bath material onto the additive. Its closed-form solution is exactly the same as that reported in the literature.
Electroweak phase transition in a model with gauged lepton number
International Nuclear Information System (INIS)
Aranda, Alfredo; Jiménez, Enrique; Vaquera-Araujo, Carlos A.
2015-01-01
In this work we study the electroweak phase transition in a model with gauged lepton number. Here, a family of vector-like leptons is required in order to cancel the gauge anomalies. Furthermore, these leptons can play an important role in the transition process. We find that this framework is able to provide a strong transition, but only for a very limited number of cases.
Characteristics of the chiral phase transition in nonlocal quark models
International Nuclear Information System (INIS)
Gomez Dumm, D. Gomez; Scoccola, N.N.
2005-01-01
The characteristics of the chiral phase transition are analyzed within the framework of chiral quark models with nonlocal interactions in the mean-field approximation. In the chiral limit, we develop a semianalytic framework that allows us to explicitly determine the phase transition curve, the position of the critical points, some relevant critical exponents, etc. For the case of finite current quark masses, we show the behavior of various thermodynamical and chiral response functions across the phase transition
Comeau, L. E.; Essery, R.; Dugmore, A.
2010-12-01
The quantity and distribution of snow across landscapes and timing of the spring snowmelt is key to a diverse range of processes, from the hydrological cycle and glaciation through to ecological and human-environment interactions. Many snow-covered landscapes are remote, inaccessible and lack observation data, especially at high resolutions and spanning multi-decadal time periods. Models are therefore valuable tools for understanding and simulating temporal and spatial variations in snow cover. The aim is to determine the most robust method of modelling snow distribution and melt across regional landscapes with limited data availability, and to apply models to understand and project variations in snow cover as a result of landscape and climate change. Physically based, high resolution snow distribution and melt models are tested through fieldwork in Sweden and Norway at research sites with detailed landscape and climate data. The impact of pseudo-limiting input data spatially and temporally on model performance and uncertainty is assessed. Methods of snow model transferral (including parameter estimation and transfer) between areas of different spatial scales and over varying time periods are explored alongside the effects on model uncertainty, with the use of additional field data from research sites in North America and Finland. The impact of variations in topography, vegetation and climate on snow distribution and melt is assessed through both fieldwork and model application, with exploration of the implications for landscape processes and populations.
DEFF Research Database (Denmark)
Mahshid, Rasoul; Hansen, Hans Nørgaard; Loft Højbjerre, Klaus
2016-01-01
Additive manufacturing is rapidly developing and gaining popularity for direct metal fabrication systems like selective laser melting (SLM). The technology has shown significant improvement for high-quality fabrication of lightweight design-efficient structures such as conformal cooling channels...
National Aeronautics and Space Administration — The goal of the proposed research is to characterize the influence of process parameter variability inherent to Selective Laser Melting (SLM) and performance effect...
Good urban transit: a conservative model
2009-02-01
For many years, transit advocates and city planners have argued that we need more and : better public transportation. Public transportation is not merely a service to the poor, something that enables people who have no car or do not drive to get arou...
Model of transition between causes of death.
Damiani, P; Aubenque, M
1975-06-01
This paper describes an attempt to estimate the probabilities of transition between various major causes of death during the period 1954-1962. The regression coefficients have been estimated from French département death rates for ten main or typical causes of death, assessed by sex for the age group 45-64 years.
On the phase transition nature in compressible Ising models
International Nuclear Information System (INIS)
Ota, A.T.
1985-01-01
The phase transition phenomenon is analysed in a compressible ferromagnetic Ising model at null field, through the mean-field approximation. The model studied is d-dimensional under the magnetic point of view and one-dimensional under the elastic point of view. This is achieved keeping the compressive interactions among the ions and rejecting annealing forces completely. The exchange parameter J is linear and the elastic potential quadratic in relation to the microscopic shifts of the lattice. In the one-dimensional case, this model shows no phase transition. In the two-dimensional case, the role of the S i spin of the i-the ion is crucial: a) for spin 1/2 the transitions are of second order; b) for spin 1, desides the second order transitions there is a three-critical point and a first-order transitions line. (L.C.) [pt
Cavicchi, Kevin; Lipowski, Brian
2013-03-01
This talk will focus on the gelation behavior of 12-hydroxystearic acid (12-HSA) in organic solvents. Thermo-reversible gelation occurs by crystallization of 12-HSA in organic solvent to form 3-D fibrillar networks. The melting point vs. composition for 12-HSA in a range of solvents has been measured. The liquidus lines could be fit with the Flory-diluent model that takes into account the non-ideal free energy of mixing and the disparity in the size of the solvent and 12-HSA molecules. The fits indicated that the effective molar volume of 12-HSA increased as the hydrogen bonding Hansen solubility parameter δh of the solvent decreased. This is attributed to the hydrogen-bonding driven aggregation of the 12-HSA in the liquid state based on previous observations that 12-HSA forms aggregated structures in non-polar solvents (e.g. dimers and tetrameters). These results indicate that the stabilization of the solid phase in 12-HSA solutions has contributions from both variations in the entropy of mixing as well the enthalpy of mixing. The importance of both these factors for designing small molecule gelators will be discussed.
Directory of Open Access Journals (Sweden)
S. Merkt
2012-01-01
Full Text Available
ENGLISH ABSTRACT: Selective laser melting (SLM is becoming an economically viable choice for manufacturing complex serial parts. This paper focuses on a geometric complexity analysis as part of the integrative technology evaluation model (ITEM presented here. In contrast to conventional evaluation methodologies, the ITEM considers interactions between product and process innovations generated by SLM. The evaluation of manufacturing processes that compete with SLM is the main goal of ITEM. The paper includes a complexity analysis of a test part from Festo AG. The paper closes with a discussion of how the expanded design freedom of SLM can be used to improve company operations, and how the complexity analysis presented here can be seen as a starting point for feature-based complexity analysis..
AFRIKAANSE OPSOMMING: Selektiewe lasersmelting word geleidelik ’n gangbare ekonomiese keuse vir die vervaar-diging van opeenvolgende komplekse onderdele. Die navorsing is toegespits op die ontleding van meetkundige kompleksiteit as ’n gedeelte van ’n integrerende tegnologiese evalueringsmodel. Gemeet teen konvensionele evalueringsmodelle behandel die genoemde metode interaksies tussen produkte- en prosesinnovasies wat gegenereer word. Die navorsing behandel ’n kompleksiteitsontleding van ’n toetsonderdeel van die firma FESTO AG. Die resultaat toon hoe kompleksiteits-analise gebruik kan word as die vertrekpunt vir eienskapsgebaseerde analise.
International Nuclear Information System (INIS)
Jahangir, Vafa; Riahifar, Reza; Sahba Yaghmaee, Maziar
2016-01-01
In order to predict as well as study the surface melting phenomena in contradiction to surface overheating, a generalized thermodynamics model including the surface free energy of solid and the melt state along with the interfacial energy of solid–liquid (melt on substrate) has been introduced. In addition, the effect of different crystal structures of surfaces in fcc, bcc and hcp metals was included in surface energies as well as in the atomistic model. These considerations lead us to predict surface melting and overheating as two contradictory melting phenomena. The results of the calculation are demonstrated on the example of Pb and Al thin films in three groups of (100), (110) and (111) surface planes. Our conclusions show good agreement with experimental results and other theoretical investigations. Moreover, a computational algorithm has been developed which enables users to investigate the surface melt or overheating of single component metallic thin film with variable crystal structures and different crystalline planes. This model and developed software can be used for studying all related surface phenomena. - Highlights: • Investigating the surface melting and overheating phenomena • Effect of crystal orientations, surface energies, geometry and different atomic surface layers • Developing a computational algorithm and its related code (free-software SMSO-Ver1) • Thickness and orientation of surface plane dominate the surface melting or overheating. • Total excess surface energy as a function of thickness and temperature explains melting.
Liquid-Liquid Phase Transition and Glass Transition in a Monoatomic Model System
Directory of Open Access Journals (Sweden)
Nicolas Giovambattista
2010-12-01
Full Text Available We review our recent study on the polyamorphism of the liquid and glass states in a monatomic system, a two-scale spherical-symmetric Jagla model with both attractive and repulsive interactions. This potential with a parametrization for which crystallization can be avoided and both the glass transition and the liquid-liquid phase transition are clearly separated, displays water-like anomalies as well as polyamorphism in both liquid and glassy states, providing a unique opportunity to study the interplay between the liquid-liquid phase transition and the glass transition. Our study on a simple model may be useful in understanding recent studies of polyamorphism in metallic glasses.
Modeling dynamic beta-gamma polymorphic transition in Tin
Chauvin, Camille; Montheillet, Frank; Petit, Jacques; CEA Gramat Collaboration; EMSE Collaboration
2015-06-01
Solid-solid phase transitions in metals have been studied by shock waves techniques for many decades. Recent experiments have investigated the transition during isentropic compression experiments and shock-wave compression and have highlighted the strong influence of the loading rate on the transition. Complementary data obtained with velocity and temperature measurements around the polymorphic transition beta-gamma of Tin on gas gun experiments have displayed the importance of the kinetics of the transition. But, even though this phenomenon is known, modeling the kinetic remains complex and based on empirical formulations. A multiphase EOS is available in our 1D Lagrangian code Unidim. We propose to present the influence of various kinetic laws (either empirical or involving nucleation and growth mechanisms) and their parameters (Gibbs free energy, temperature, pressure) on the transformation rate. We compare experimental and calculated velocities and temperature profiles and we underline the effects of the empirical parameters of these models.
The electroweak phase transition in the Inert Doublet Model
Energy Technology Data Exchange (ETDEWEB)
Blinov, Nikita [Department of Physics, University of California Santa Cruz,1156 High St, Santa Cruz, CA 95064 (United States); Santa Cruz Institute for Particle Physics,1156 High St, Santa Cruz, CA 95064 (United States); Theory Department, TRIUMF,4004 Wesbrook Mall, Vancouver, BC V6T 2A3 (Canada); Department of Physics and Astronomy, University of British Columbia,Vancouver, BC V6T 1Z1 (Canada); Profumo, Stefano; Stefaniak, Tim [Department of Physics, University of California Santa Cruz,1156 High St, Santa Cruz, CA 95064 (United States); Santa Cruz Institute for Particle Physics,1156 High St, Santa Cruz, CA 95064 (United States)
2015-07-21
We study the strength of a first-order electroweak phase transition in the Inert Doublet Model (IDM), where particle dark matter (DM) is comprised of the lightest neutral inert Higgs boson. We improve over previous studies in the description and treatment of the finite-temperature effective potential and of the electroweak phase transition. We focus on a set of benchmark models inspired by the key mechanisms in the IDM leading to a viable dark matter particle candidate, and illustrate how to enhance the strength of the electroweak phase transition by adjusting the masses of the yet undiscovered IDM Higgs states. We argue that across a variety of DM masses, obtaining a strong enough first-order phase transition is a generic possibility in the IDM. We find that due to direct dark matter searches and collider constraints, a sufficiently strong transition and a thermal relic density matching the universal DM abundance is possible only in the Higgs funnel regime.
The electroweak phase transition in the Inert Doublet Model
Energy Technology Data Exchange (ETDEWEB)
Blinov, Nikita; Profumo, Stefano; Stefaniak, Tim, E-mail: nblinov@triumf.ca, E-mail: profumo@ucsc.edu, E-mail: tistefan@ucsc.edu [Department of Physics, University of California Santa Cruz, 1156 High St, Santa Cruz, CA 95064 (United States)
2015-07-01
We study the strength of a first-order electroweak phase transition in the Inert Doublet Model (IDM), where particle dark matter (DM) is comprised of the lightest neutral inert Higgs boson. We improve over previous studies in the description and treatment of the finite-temperature effective potential and of the electroweak phase transition. We focus on a set of benchmark models inspired by the key mechanisms in the IDM leading to a viable dark matter particle candidate, and illustrate how to enhance the strength of the electroweak phase transition by adjusting the masses of the yet undiscovered IDM Higgs states. We argue that across a variety of DM masses, obtaining a strong enough first-order phase transition is a generic possibility in the IDM. We find that due to direct dark matter searches and collider constraints, a sufficiently strong transition and a thermal relic density matching the universal DM abundance is possible only in the Higgs funnel regime.
Directory of Open Access Journals (Sweden)
Kakimuma F.
2011-05-01
Full Text Available The sound velocity and magnetic susceptibility as a function of temperature and composition were measured to investigate critical sound wave propagation and metal-non-metal transition in the liquid Sb-Sb2S3 system. The sound velocity in a homogeneous alloy around 60 at.% of Sb decreases very rapidly and the rate of decrease increases as the two melts phase is approached, which is the typical temperature dependence of the sound velocity in a liquid with a miscibility gap. Below the critical point, the sound velocity was measured along the phase boundary. Using those data, the phase boundary was precisely determined. The critical point is located at 901±2°C and 41.5 ±0.5 at.% S, and the critical exponent of the phase boundary is about 1/3. On the other hand, the magnetic susceptibility as a function of temperature and composition indicates that the electronic state is metallic in liquid Sb and non-metallic in molten Sb2Se3, and crossover form the metallic to non-metallic state occurs around the critical composition.
Brown, K. L.; Parker, S. F.; García, I. Robles; Mukhopadhyay, S.; Sakai, V. García; Stock, C.
2017-11-01
Lead-halide organic-inorganic perovskites consist of an inorganic host framework with an organic molecule occupying the interstitial space. The structure and dynamics of these materials have been heavily studied recently due to interest in their exceptional photovoltaic properties. We combine inelastic neutron scattering, Raman spectroscopy, and quasielastic neutron scattering to study the temperature dependent dynamics of the molecular cation in CH3NH3PbBr3 . By applying high resolution quasielastic neutron scattering, we confirm the [CH3NH3] + ions are static in the low temperature orthorhombic phase yet become dynamic above 150 K where a series of structural transitions occur. This molecular melting is accompanied by a temporal broadening in the intramolecular modes probed through high energy inelastic spectroscopy. Simultaneous Raman measurements, a strictly |Q |=0 probe, are suggestive that this broadening is due to local variations in the crystal field environment around the hydrogen atoms. These results confirm the strong role of hydrogen bonding and also a coupling between molecular and framework dynamics.
Carenzo, Marco; Mabillard, Johan; Pellicciotti, Francesca; Reid, Tim; Brock, Ben; Burlando, Paolo
2013-04-01
The increase of rockfalls from the surrounding slopes and of englacial melt-out material has led to an increase of the debris cover extent on Alpine glaciers. In recent years, distributed debris energy-balance models have been developed to account for the melt rate enhancing/reduction due to a thin/thick debris layer, respectively. However, such models require a large amount of input data that are not often available, especially in remote mountain areas such as the Himalaya. Some of the input data such as wind or temperature are also of difficult extrapolation from station measurements. Due to their lower data requirement, empirical models have been used in glacier melt modelling. However, they generally simplify the debris effect by using a single melt-reduction factor which does not account for the influence of debris thickness on melt. In this paper, we present a new temperature-index model accounting for the debris thickness feedback in the computation of melt rates at the debris-ice interface. The empirical parameters (temperature factor, shortwave radiation factor, and lag factor accounting for the energy transfer through the debris layer) are optimized at the point scale for several debris thicknesses against melt rates simulated by a physically-based debris energy balance model. The latter has been validated against ablation stake readings and surface temperature measurements. Each parameter is then related to a plausible set of debris thickness values to provide a general and transferable parameterization. The new model is developed on Miage Glacier, Italy, a debris cover glacier in which the ablation area is mantled in near-continuous layer of rock. Subsequently, its transferability is tested on Haut Glacier d'Arolla, Switzerland, where debris is thinner and its extension has been seen to expand in the last decades. The results show that the performance of the new debris temperature-index model (DETI) in simulating the glacier melt rate at the point scale
On the chiral phase transition in the linear sigma model
International Nuclear Information System (INIS)
Tran Huu Phat; Nguyen Tuan Anh; Le Viet Hoa
2003-01-01
The Cornwall- Jackiw-Tomboulis (CJT) effective action for composite operators at finite temperature is used to investigate the chiral phase transition within the framework of the linear sigma model as the low-energy effective model of quantum chromodynamics (QCD). A new renormalization prescription for the CJT effective action in the Hartree-Fock (HF) approximation is proposed. A numerical study, which incorporates both thermal and quantum effect, shows that in this approximation the phase transition is of first order. However, taking into account the higher-loop diagrams contribution the order of phase transition is unchanged. (author)
Modeling Enzymatic Transition States by Force Field Methods
DEFF Research Database (Denmark)
Hansen, Mikkel Bo; Jensen, Hans Jørgen Aagaard; Jensen, Frank
2009-01-01
The SEAM method, which models a transition structure as a minimum on the seam of two diabatic surfaces represented by force field functions, has been used to generate 20 transition structures for the decarboxylation of orotidine by the orotidine-5'-monophosphate decarboxylase enzyme. The dependence...... by various electronic structure methods, where part of the enzyme is represented by a force field description and the effects of the solvent are represented by a continuum model. The relative energies vary by several hundreds of kJ/mol between the transition structures, and tests showed that a large part...
Directory of Open Access Journals (Sweden)
Dawn N Birdsell
Full Text Available Single nucleotide polymorphisms (SNPs are abundant in genomes of all species and biologically informative markers extensively used across broad scientific disciplines. Newly identified SNP markers are publicly available at an ever-increasing rate due to advancements in sequencing technologies. Efficient, cost-effective SNP genotyping methods to screen sample populations are in great demand in well-equipped laboratories, but also in developing world situations. Dual Probe TaqMan assays are robust but can be cost-prohibitive and require specialized equipment. The Mismatch Amplification Mutation Assay, coupled with melt analysis (Melt-MAMA, is flexible, efficient and cost-effective. However, Melt-MAMA traditionally suffers from high rates of assay design failures and knowledge gaps on assay robustness and sensitivity. In this study, we identified strategies that improved the success of Melt-MAMA. We examined the performance of 185 Melt-MAMAs across eight different pathogens using various optimization parameters. We evaluated the effects of genome size and %GC content on assay development. When used collectively, specific strategies markedly improved the rate of successful assays at the first design attempt from ~50% to ~80%. We observed that Melt-MAMA accurately genotypes across a broad DNA range (~100 ng to ~0.1 pg. Genomic size and %GC content influence the rate of successful assay design in an independent manner. Finally, we demonstrated the versatility of these assays by the creation of a duplex Melt-MAMA real-time PCR (two SNPs and conversion to a size-based genotyping system, which uses agarose gel electrophoresis. Melt-MAMA is comparable to Dual Probe TaqMan assays in terms of design success rate and accuracy. Although sensitivity is less robust than Dual Probe TaqMan assays, Melt-MAMA is superior in terms of cost-effectiveness, speed of development and versatility. We detail the parameters most important for the successful application of
GLASS MELTING PHENOMENA, THEIR ORDERING AND MELTING SPACE UTILISATION
Directory of Open Access Journals (Sweden)
Němec L.
2013-12-01
Full Text Available Four aspects of effective glass melting have been defined – namely the fast kinetics of partial melting phenomena, a consideration of the melting phenomena ordering, high utilisation of the melting space, and effective utilisation of the supplied energy. The relations were defined for the specific melting performance and specific energy consumption of the glass melting process which involve the four mentioned aspects of the process and indicate the potentials of effective melting. The quantity “space utilisation” has been treated in more detail as an aspect not considered in practice till this time. The space utilisation was quantitatively defined and its values have been determined for the industrial melting facility by mathematical modelling. The definitions of the specific melting performance and specific energy consumption have been used for assessment of the potential impact of a controlled melt flow and high space utilisation on the melting process efficiency on the industrial scale. The results have shown that even the partial control of the melt flow, leading to the partial increase of the space utilisation, may considerably increase the melting performance, whereas a decrease of the specific energy consumption was determined to be between 10 - 15 %.
Energy Technology Data Exchange (ETDEWEB)
Bouvier, A. [Electricite de France, 77 - Moret sur Loing (France). Direction des Etudes et Recherches; Trenty, L.; Guillot, J.B. [Ecole Centrale de Paris, Laboratoire EM2C. CNRS, 92 - Chatenay-Malabry (France); Delalondre, C. [Electricite de France (EDF), 78 - Chatou (France). Direction des Etudes et Recherches
1997-12-31
This paper presents the modeling of a transferred electric arc inside a bath of melted metal. After a recall of the context of the study, the problem of the modeling, which involves magnetohydrodynamic coupling inside the arc and the bath, is described. The equations that govern the phenomena inside the arc and the bath are recalled and the approach used for the modeling of the anode region of the arc is explained using a 1-D sub-model. The conditions of connection between arc and bath calculations are explained and calculation results obtained with a 200 kW laboratory furnace geometry are presented. (J.S.) 8 refs.
Dynamic fragmentation of laser shock-melted tin: experiment and modelling
Energy Technology Data Exchange (ETDEWEB)
De Resseguier, T. [CNRS ENSMA, Lab Combust and Deton, F-86961 Futuroscope (France); Signor, L.; Dragon, A. [CNRS ENSMA, Mecan and Phys Mat Lab, F-86961 Futuroscope (France); Signor, L.; Roy, G. [CEA Valduc, 21 - Is-sur-Tille (France)
2010-07-01
Dynamic fragmentation of shock-loaded metals is an issue of considerable importance for both basic science and a variety of technological applications, such as pyrotechnics or inertial confinement fusion, the latter involving high energy laser irradiation of thin metallic shells. Whereas spall fracture in solid materials has been extensively studied for many years, little data can be found yet about the evolution of this phenomenon after partial or full melting on compression or on release. Here, we present an investigation of dynamic fragmentation in laser shock-melted tin, from the 'micro-spall' process (ejection of a cloud of fine droplets) occurring upon reflection of the compressive pulse from the target free surface, to the late rupture observed in the un-spalled melted layer (leading to the formation of larger spherical fragments). Experimental results consist of time-resolved velocity measurements and post-shock observations of recovered targets and fragments. They provide original information regarding the loss of tensile strength associated with melting, the cavitation mechanism likely to occur in the melted metal, the sizes of the subsequent fragments and their ejection velocities. A theoretical description based on an energetic approach adapted to the case of a liquid metal is implemented as a failure criterion in a one-dimensional hydro-code including a multi-phase equation of state for tin. The resulting predictions of the micro-spall process are compared with experimental data. In particular, the use of a new experimental technique to quantify the fragment size distributions leads to a much better agreement with theory than previously reported. Finally, a complementary approach focused on cavitation is proposed to evaluate the role of this phenomenon in the fragmentation of the melted metal. (authors)
Directory of Open Access Journals (Sweden)
V. I. Timoshpolskij
2006-01-01
Full Text Available The methods of calculation of duration of the metallic bricks heating and melting in liquid bath, taking into account variability of thermal-physical characteristics of metal due to temperature, is developed.
DEFF Research Database (Denmark)
von Essen, C.; Cellone, S.; Mallonn, M.
2016-01-01
The transit timing variation technique (TTV) has been widely used to detect and characterize multiple planetary systems. Due to the observational biases imposed mainly by the photometric conditions and instrumentation and the high signal-to-noise required to produce primary transit observations...... the observing time at hand carrying out such follow-ups, or if the use of medium-to-low quality transit light curves, combined with current standard techniques of data analysis, could be playing a main role against exoplanetary search via TTVs. The purpose of this work is to investigate to what extent ground......-based observations treated with current modelling techniques are reliable to detect and characterize additional planets in already known planetary systems. To meet this goal, we simulated typical primary transit observations of a hot Jupiter mimicing an existing system, Qatar-1. To resemble ground-based observations...
The generalized model of polypeptide chain describing the helix-coil transition in biopolymers
International Nuclear Information System (INIS)
Mamasakhlisov, E.S.; Badasyan, A.V.; Tsarukyan, A.V.; Grigoryan, A.V.; Morozov, V.F.
2005-07-01
In this paper we summarize some results of our theoretical investigations of helix-coil transition both in single-strand (polypeptides) and two-strand (polynucleotides) macromolecules. The Hamiltonian of the Generalized Model of Polypeptide Chain (GMPC) is introduced to describe the system in which the conformations are correlated over some dimensional range Δ (it equals 3 for polypeptide, because one H-bond fixes three pairs of rotation, for double strand DNA it equals to one chain rigidity because of impossibility of loop formation on the scale less than Δ). The Hamiltonian does not contain any parameter designed especially for helix-coil transition and uses pure molecular microscopic parameters (the energy of hydrogen bond formation, reduced partition function of repeated unit, the number of repeated units fixed by one hydrogen bond, the energies of interaction between the repeated units and the solvent molecules). To calculate averages we evaluate the partition function using the transfer-matrix approach. The GMPC allowed to describe the influence of a number of factors, affecting the transition, basing on a unified microscopic approach. Thus we obtained, that solvents change transition temperature and interval in different ways, depending on type of solvent and on energy of solvent- macromolecule interaction; stacking on the background of H-bonding increases stability and decreases cooperativity of melting. For heterogeneous DNA we could analytically derive well known formulae for transition temperature and interval. In the framework of GMPC we calculate and show the difference of two order parameters of helix-coil transition - the helicity degree, and the average fraction of repeated units in helical conformation. Given article has the aim to review the results obtained during twenty years in the context of GMPC. (author)
Modelling of the isothermal replication of surface microstructures in polymer melts
DEFF Research Database (Denmark)
Rasmussen, Henrik Koblitz; Eriksson, Torbjörn Gerhard
2005-01-01
) melt. A round PC or PS plate with a thickness of 3 mm and a diameter of 59 mm was placed between and at the centre of two squared steel plate. The bottom plate is equipped with a microstructured nickel insert, positioned 46 mm from the middle of the steel plate. The insert contained 10 parallel...... to the incoming molten plastic flow. Just before the flow-front of the melt reached the end of the inserts the polymer was frozen. The replicated PC and PS micro-structures were examined using a confocal laser scanning microscope. Uniaxial elongational viscosity and linear viscoelasticity were used...
Experimental constraints on the degree of melting beneath tectonic plates
Clark, A. N.; Lesher, C. E.
2017-12-01
Determining the volume and geometric distribution of silicate melts is fundamentally important to understand the current structure of the Earth as well as the dynamics of the Earth's interior. Regions in the upper mantle and crust that have lower velocities than the 1D global average are commonly attributed to the presence of silicate melts. Constraining melt fraction and distribution from seismic data requires a robust equation of state for silicate melts. Commonly, silicate melts are modeled at high pressure using equations of state developed for crystalline materials (e.g. the Birch-Murnaghan equation of state). However, amorphous silicates (glasses and melts), which lack long-range ordering, violate Birch's law at high pressures and high temperatures (Clark et al., 2016). We present a new model for seismic velocity reductions that accounts for the violation of Birch's law (anomalous compressibility) observed in amorphous silicates, rendering compressional wave velocities more sensitive to melt fraction and distribution than previous estimates. Forward modeling that combines our experimental data with the analytical solution of Takei (2002) predicts comparable velocity reductions for compressional and shear waves for partially molten mantle. Additionally, models that use crystalline equations of state to determine melt fraction at high pressure may overestimate melt fraction by 20% at pressures corresponding to the lithosphere-asthenosphere boundary (LAB) with the overestimation increasing with depth (e.g. a factor of 2 at the transition zone). By applying our results to recent seismic studies below the western Pacific plate that have reported low velocity regions associated with the lithosphere - asthenosphere boundary (LAB), we predict melt present at Journal of Geophysical Research: Solid Earth, v. 121, no. 6, p. 4232-4248. Takei, Y., 2002, Journal of Geophysical Research: Solid Earth (1978-2012), v. 107, no. B2, p. 6-12.
van Dam, L.; Kincaid, C. R.; Pockalny, R. A.; Sylvia, R. T.; Hall, P. S.
2017-12-01
Lateral migration of mid-ocean ridge spreading centers is a well-documented phenomenon leading to asymmetric melt production and the surficial expressions thereof. This form of plate motion has been difficult to incorporate into both numerical and analogue geodynamical models, and consequently, current estimates of time-dependent flow, material transport, and melting in the mantle beneath ridges are lacking. To address this, we have designed and built an innovative research apparatus that allows for precise and repeatable simulations of mid-ocean ridge spreading and migration. Three pairs of counter-rotating belts with adjustable lateral orientations are scaled to simulate spreading at, and flow beneath, three 600km wide ridge segments with up to 300km transform offsets. This apparatus is attached to a drive system that allows us to test a full range of axis-parallel to axis-normal migration directions, and is suspended above a reservoir of viscous glucose syrup, a scaled analogue for the upper mantle, and neutrally buoyant tracers. We image plate-driven flow in the syrup with high-resolution digital cameras and use particle image velocimetry methods to obtain information about transport pathlines and flow-induced anisotropy. Suites of experiments are run with and without ridge migration to determine the overall significance of migration on spatial and temporal characteristics of shallow mantle flow. Our experiments cover an expansive parameter space by including various spreading rates, migration speeds and directions, degrees of spreading asymmetry, transform-offset lengths, and upper mantle viscosity conditions. Preliminary results highlight the importance of modeling migratory plate forces. Mantle material exhibits a significant degree of lateral transport, particularly between ridge segments and towards the melt triangle. Magma supply to the melting region is highly complex; parcels of material do not necessarily move along fixed streamlines, rather, they can
CFD-based model for melt flow in laser beam welding of aluminium with coaxial magnetic field
Gatzen, M.; Tang, Z.
The use of magnetic fields to influence weld bead shape and dilution in laser welding of aluminium alloys was recently suggested. For the case of laser welding of hot-cracking sensitive aluminium alloys with silicon-containing filler wire it was already demonstrated that applying alternating magnetic fields has an impact on the dilution of silicon in the melt pool, yielding sufficient silicon content throughout the weld to suppress hot-cracking. This is due to the changed melt flow condition resulting from induced magnetic volume forces. In this paper, a CFD-based model will be presented that was used to numerically calculate the resulting velocity field for laser beam welding of aluminium with external applied magnetic fields. The model includes temperaturedepending material properties, surface tension and buoyancy. The inhomogeneous magnetic flux density distribution implemented in this model has been derived from Hall sensor probes of a welding head prototype used for experimental investigations. It is shown that a steady magnetic field applied coaxially to the laser beam will affect the direction of melt flow and can be described as an inhomogeneous electromagnetic break.
Energy Technology Data Exchange (ETDEWEB)
Greenberg, J. M.
2003-07-16
In a previous paper the author and Demay advanced a model to explain the melt fracture instability observed when molten linear polymer melts are extruded in a capillary rheometer operating under the controlled condition that the inlet flow rate was held constant. The model postulated that the melts were a slightly compressible viscous fluid and allowed for slipping of the melt at the wall. The novel feature of that model was the use of an empirical switch law which governed the amount of wall slip. The model successfully accounted for the oscillatory behavior of the exit flow rate, typically referred to as the melt fracture instability, but did not simultaneously yield the fine scale spatial oscillations in the melt typically referred to as shark skin. In this note a new model is advanced which simultaneously explains the melt fracture instability and shark skin phenomena. The model postulates that the polymer is a slightly compressible linearly viscous fluid but assumes no slip boundary conditions at the capillary wall. In simple shear the shear stress {tau}and strain rate d are assumed to be related by d = F{tau} where F ranges between F{sub 2} and F{sub 1} > F{sub 2}. A strain rate dependent yield function is introduced and this function governs whether F evolves towards F{sub 2} or F{sub 1}. This model accounts for the empirical observation that at high shears polymers align and slide more easily than at low shears and explains both the melt fracture and shark skin phenomena.
Tirone, M.; Ganguly, J.
2011-12-01
and a viscosity drop by ~ an order of magnitude from the transition zone to the top of the lower mantle. The latter result is in contrast to the viscosity jump inferred from geophysical observations. This conclusion applies for the present day most relevant thermal conditions retrieved from the thermal history model. However it is possible that using a multiphase model for the rock assemblage in the transition zone the mineralogical and geophysical models may be in better agreement. As it would be shown here, the viscosity model (and the thermal state of the CMB) combined with a thermodynamic formulation allows us to study the geodynamics of mantle plumes with a considerably smaller number of assumptions than in previous studies. The thermal evolution of the plume in the upper mantle is then applied to model the petrological evolution of melting in hot spots using a coupled thermodynamic and two phase flow model (session DI03, contribution entitled: Present Day Hot Spot Melting Inferred from Geodynamics and Thermodynamics Modeling and the Thermal History of the Mantle).
Allosteric transition: a comparison of two models
DEFF Research Database (Denmark)
Bindslev, Niels
2013-01-01
Introduction Two recent models are in use for analysis of allosteric drug action at receptor sites remote from orthosteric binding sites. One is an allosteric two-state mechanical model derived in 2000 by David Hall. The other is an extended operational model developed in 2007 by Arthur Christopo...
Matt, F.; Burkhart, J. F.
2017-12-01
Light absorbing impurities in snow and ice (LAISI) originating from atmospheric deposition enhance snow melt by increasing the absorption of solar radiation. The consequences are a shortening of the snow cover duration due to increased snow melt and, with respect to hydrologic processes, a temporal shift in the discharge generation. However, the effects as simulated in numerical models have large uncertainties. These uncertainties originate mainly from uncertainties in the wet and dry deposition of light absorbing aerosols, limitations in the model representation of the snowpack, and the lack of observable variables required to estimate model parameters. This leads to high uncertainties in the additional energy absorbed by the snow due to the presence of LAISI (the so called radiative forcing of LAISI), a key variable in understanding snowpack energy-balance dynamics. In this study, we present an approach combining distributed model simulations on the catchment scale and remotely sensed radiative forcing from LAISI in order to evaluate and improve model predictions. In a case study, we assess the effect of LAISI on snow melt and discharge generation in a high mountain catchment located in the western Himalaya using the distributed hydrologic model, Shyft. The snow albedo is hereby calculated from a radiative transfer model for snow, taking the increased absorption of solar radiation by LAISI into account. LAISI mixing ratios in snow are determined from atmospheric aerosol deposition rates. To asses the quality of our simulations, we model the instantaneous clear sky radiative forcing at MODIS overpass times, and compare it to the MODIS Dust Radiative Forcing in Snow (MODDRFS) satellite product. By scaling the deposition input to the model, we can optimize the simulated radiative forcing towards the satellite observations.
Point, surface and volumetric heat sources in the thermal modelling of selective laser melting
Yang, Y.; Ayas, C.; Brabazon, Dermot; Naher, Sumsun; Ul Ahad, Inam
2017-01-01
Selective laser melting (SLM) is a powder based additive manufacturing technique suitable for producing high precision metal parts. However, distortions and residual stresses within products arise during SLM because of the high temperature gradients created by the laser heating. Residual stresses
A semi-analytical thermal modelling approach for selective laser melting
Yang, Y.; van Keulen, A.; Ayas, C.
2018-01-01
Selective laser melting (SLM) wherein a metal part is built in a layer-by-layer manner in a powder bed is a promising and versatile way for manufacturing components with complex geometry. However, components built by SLM suffer from substantial deformation of the part and residual stresses.
Heat and mass transfer in semiconductor melts during single-crystal growth processes
Kakimoto, Koichi
1995-03-01
The quality of large semiconductor crystals grown from melts is significantly affected by the heat and mass transfer in the melts. The current understanding of the phenomena, especially melt convection, is reviewed starting from the results of visualization using model fluids or silicon melt, and continuing to the detailed numerical calculations needed for quantitative modeling of processing with solidification. The characteristics of silicon flows are also reviewed by focusing on the Coriolis force in the rotating melt. Descriptions of flow instabilities are included that show the level of understanding of melt convection with a low Prandtl number. Based on hydrodynamics, the origin of the silicon flow structure is reviewed, and it is discussed whether silicon flow is completely turbulent or has an ordered structure. The phase transition from axisymmetric to nonaxisymmetric flow is discussed using different geometries. Additionally, surface-tension-driven flow is reviewed for Czochralski crystal growth systems.
Energy Technology Data Exchange (ETDEWEB)
Gu, Dongdong, E-mail: dongdonggu@nuaa.edu.cn; Dai, Donghua [College of Materials Science and Technology, Nanjing University of Aeronautics and Astronautics, Yudao Street 29, Nanjing 210016 (China); Institute of Additive Manufacturing (3D Printing), Nanjing University of Aeronautics and Astronautics, Yudao Street 29, Nanjing 210016 (China)
2016-08-28
A transient three dimensional model for describing the molten pool dynamics and the response of oxidation film evolution in the selective laser melting of aluminum-based material is proposed. The physical difference in both sides of the scan track, powder-solid transformation and temperature dependent physical properties are taken into account. It shows that the heat energy tends to accumulate in the powder material rather than in the as-fabricated part, leading to the formation of the asymmetrical patterns of the temperature contour and the attendant larger dimensions of the molten pool in the powder phase. As a higher volumetric energy density is applied (≥1300 J/mm{sup 3}), a severe evaporation is produced with the upward direction of velocity vector in the irradiated powder region while a restricted operating temperature is obtained in the as-fabricated part. The velocity vector continuously changes from upward direction to the downward one as the scan speed increases from 100 mm/s to 300 mm/s, promoting the generation of the debris of the oxidation films and the resultant homogeneous distribution state in the matrix. For the applied hatch spacing of 50 μm, a restricted remelting phenomenon of the as-fabricated part is produced with the upward direction of the convection flow, significantly reducing the turbulence of the thermal-capillary convection on the breaking of the oxidation films, and therefore, the connected oxidation films through the neighboring layers are typically formed. The morphology and distribution of the oxidation are experimentally acquired, which are in a good agreement with the results predicted by simulation.
Complexity and phase transitions in a holographic QCD model
Zhang, Shao-Jun
2018-04-01
Applying the "Complexity = Action" conjecture, we study the holographic complexity close to crossover/phase transition in a holographic QCD model proposed by Gubser et al. This model can realize three types of phase transition, crossover or first and second order, depending on the parameters of the dilaton potential. The re-scaled late-time growth rate of holographic complexity density for the three cases is calculated. Our results show that it experiences a fast drop/jump close to the critical point while approaching constants far beyond the critical temperature. Moreover, close to the critical temperature, it shows a behavior characterizing the type of the transition. These features suggest that the growth rate of the holographic complexity may be used as a good parameter to characterize the phase transition. The Lloyd's bound is always satisfied for the cases we considered but only saturated for the conformal case.
TPmsm: Estimation of the Transition Probabilities in 3-State Models
Directory of Open Access Journals (Sweden)
Artur Araújo
2014-12-01
Full Text Available One major goal in clinical applications of multi-state models is the estimation of transition probabilities. The usual nonparametric estimator of the transition matrix for non-homogeneous Markov processes is the Aalen-Johansen estimator (Aalen and Johansen 1978. However, two problems may arise from using this estimator: first, its standard error may be large in heavy censored scenarios; second, the estimator may be inconsistent if the process is non-Markovian. The development of the R package TPmsm has been motivated by several recent contributions that account for these estimation problems. Estimation and statistical inference for transition probabilities can be performed using TPmsm. The TPmsm package provides seven different approaches to three-state illness-death modeling. In two of these approaches the transition probabilities are estimated conditionally on current or past covariate measures. Two real data examples are included for illustration of software usage.
Wolf, A. S.; Asimow, P. D.; Stevenson, D. J.
2015-12-01
Recent first-principles calculations (e.g. Stixrude, 2009; de Koker, 2013), shock-wave experiments (Mosenfelder, 2009), and diamond-anvil cell investigations (Sanloup, 2013) indicate that silicate melts undergo complex structural evolution at high pressure. The observed increase in cation-coordination (e.g. Karki, 2006; 2007) induces higher compressibilities and lower adiabatic thermal gradients in melts as compared with their solid counterparts. These properties are crucial for understanding the evolution of impact-generated magma oceans, which are dominated by the poorly understood behavior of silicates at mantle pressures and temperatures (e.g. Stixrude et al. 2009). Probing these conditions is difficult for both theory and experiment, especially given the large compositional space (MgO-SiO2-FeO-Al2O3-etc). We develop a new model to understand and predict the behavior of oxide and silicate melts at extreme P-T conditions (Wolf et al., 2015). The Coordinated Hard Sphere Mixture (CHaSM) extends the Hard Sphere mixture model, accounting for the range of coordination states for each cation in the liquid. Using approximate analytic expressions for the hard sphere model, this fast statistical method compliments classical and first-principles methods, providing accurate thermodynamic and structural property predictions for melts. This framework is applied to the MgO system, where model parameters are trained on a collection of crystal polymorphs, producing realistic predictions of coordination evolution and the equation of state of MgO melt over a wide P-T range. Typical Mg-coordination numbers are predicted to evolve continuously from 5.25 (0 GPa) to 8.5 (250 GPa), comparing favorably with first-principles Molecular Dynamics (MD) simulations. We begin extending the model to a simplified mantle chemistry using empirical potentials (generally accurate over moderate pressure ranges, consuming classical MD calculations. This approach also sheds light on the universality
Barry, Brendan
2015-11-01
Studies over the last decade have reported power law distributions for the sizes of terrestrial lakes & Arctic melt ponds, as well as relationships between their area & the fractal dimension of their contours. These systems are important for the climate system, in terms of carbon cycling & ice-albedo feedback, respectively; these distributions offer promise for improved quantification & description of their influence. However, a mechanistic explanation of their distribution is lacking, & both systems remain difficult to observe logistically. Here we report 1) a simple mechanistic model for the distribution of lakes & melt ponds, based on statistical topography, which neatly predicts their distribution & the relationship between area & fractal dimension, as well as 2) the existence of a similar phenomena in tidal mud flats. Data was collected at low tide in a tidal bed near Damariscotta, Maine, which reveals a power law size distribution over a large dynamic range & a well-defined compatible fractal dimension. This data set significantly extends the observed spatiotemporal range of such phenomena, & suggests this easily observable system may be an ideal model for lakes & melt ponds. MIT-WHOI Jiont Program, Physical Oceanography.
Energy Technology Data Exchange (ETDEWEB)
Xu, Wen-Sheng, E-mail: wsxu@uchicago.edu [James Franck Institute, The University of Chicago, Chicago, Illinois 60637 (United States); Freed, Karl F., E-mail: freed@uchicago.edu [James Franck Institute, The University of Chicago, Chicago, Illinois 60637 (United States); Department of Chemistry, The University of Chicago, Chicago, Illinois 60637 (United States)
2015-07-14
The lattice cluster theory (LCT) for the thermodynamics of polymer systems has recently been reformulated to treat strongly interacting self-assembling polymers composed of fully flexible linear telechelic chains [J. Dudowicz and K. F. Freed, J. Chem. Phys. 136, 064902 (2012)]. Here, we further extend the LCT for linear telechelic polymer melts to include a description of chain semiflexibility, which is treated by introducing a bending energy penalty whenever a pair of consecutive bonds from a single chain lies along orthogonal directions. An analytical expression for the Helmholtz free energy is derived for the model of semiflexible linear telechelic polymer melts. The extension provides a theoretical tool for investigating the influence of chain stiffness on the thermodynamics of self-assembling telechelic polymers, and for further exploring the influence of self-assembly on glass formation in such systems.
Ivanov, B. A.
2005-01-01
The presence of water/ice/brine in upper layers of Martian crust affects many processes of impact cratering. Modeling of these effects promises better understanding of Martian cratering records. We present here the new ANEOS-based multiphase equation of state for water/ice constructed for usage in hydrocodes and first numerical experiments on permafrost shock melting. Preliminary results show that due to multiple shock compression of ice inclusions in rocks the entropy jump in shocked ice is smaller than in pure ice for the same shock pressure. Hence previous estimates of ice melting during impact cratering on Mars should be re-evaluated. Additional information is included in the original extended abstract.
Directory of Open Access Journals (Sweden)
E. Rets
2017-01-01
Full Text Available Frequency and intensity of river floods rise observed in the North Caucasus during last decades is considered to be driven by recent climate change. In order to predict possible future trends in extreme hydrological events in the context of climate change, it is essential to estimate the contribution of different feed sources in complicated flow-forming processes in the alpine part of the North Caucasus. A study was carried out for the Djankuat River basin, the representative for the North Caucasus system. Simultaneous measurements of electrical conductivity, isotopic and ion balance equations, and energy balance modeling of ice and snow melt were used to evaluate the contribution of different sources and processes in the Djankuat River runoff regime formation. A forecast of possible future changes in the Djankuat glacier melting regime according to the predicted climate changes was done.
International Nuclear Information System (INIS)
Mayer, Alexander E.; Mayer, Polina N.
2015-01-01
A continuum model of the metal melt fracture is formulated on the basis of the continuum mechanics and theory of metastable liquid. A character of temperature and strain rate dependences of the tensile strength that is predicted by the continuum model is verified, and parameters of the model are fitted with the use of the results of the molecular dynamics simulations for ultra-high strain rates (≥1–10/ns). A comparison with experimental data from literature is also presented for Al and Ni melts. Using the continuum model, the dynamic tensile strength of initially uniform melts of Al, Cu, Ni, Fe, Ti, and Pb within a wide range of strain rates (from 1–10/ms to 100/ns) and temperatures (from melting temperature up to 70–80% of critical temperature) is calculated. The model is applied to numerical investigation of a problem of the high-current electron irradiation of Al, Cu, and Fe targets
A Correlation-Based Transition Model using Local Variables. Part 1; Model Formation
Menter, F. R.; Langtry, R. B.; Likki, S. R.; Suzen, Y. B.; Huang, P. G.; Volker, S.
2006-01-01
A new correlation-based transition model has been developed, which is based strictly on local variables. As a result, the transition model is compatible with modern computational fluid dynamics (CFD) approaches, such as unstructured grids and massive parallel execution. The model is based on two transport equations, one for intermittency and one for the transition onset criteria in terms of momentum thickness Reynolds number. The proposed transport equations do not attempt to model the physics of the transition process (unlike, e.g., turbulence models) but from a framework for the implementation of correlation-based models into general-purpose CFD methods.
International Nuclear Information System (INIS)
Agethen, K.; Koch, M.K.
2016-04-01
The present report is the 3 rd Technical Report within the research project ''ASMO'' founded by the German Federal Ministry for Economic Affairs and Energy (BMWi 1501433) and projected at the Chair of Energy Systems and Energy Economics (LEE) within the workgroup Reactor Simulation and Safety at the Ruhr-Universitaet Bochum (RUB). The focus in this report is set on the release of fission products and the contribution to the source term, which is formed in the late phase after failure of the reactor pressure vessel during MCCI. By comparing the RUB simulation results including the fission product release rates with further simulations of GRS and VEIKI it can be indicated that the simulations have a high sensitivity in respect to the melting point temperature. It can be noted that the release rates are underestimated for most fission product species with the current model. Especially semi-volatile fission products and the lanthanum release is underestimated by several orders of magnitude. Based on the ACE experiment L2, advanced considerations are presented concerning the melt temperature, the gas temperature, the segregation and a varied melt configuration. Furthermore, the influence of the gas velocity is investigated. This variation of the gas velocity causes an underestimation of the release rates compared to the RUB base calculation. A model extension to oxidic species for lanthanum and ruthenium shows a significant improvement of the simulation results. In addition, the MEDICIS module has been enhanced to document the currently existing species, are displayed in a *.ist-file. This expansion shows inconsistencies between the melt composition and the fission product composition. Based on these results, there are still some difficulties regarding the release of fission products in the MEDICIS module and the interaction with the material data base (MOB) which needs further investigation.
Analytic Scattering and Refraction Models for Exoplanet Transit Spectra
Robinson, Tyler D.; Fortney, Jonathan J.; Hubbard, William B.
2017-12-01
Observations of exoplanet transit spectra are essential to understanding the physics and chemistry of distant worlds. The effects of opacity sources and many physical processes combine to set the shape of a transit spectrum. Two such key processes—refraction and cloud and/or haze forward-scattering—have seen substantial recent study. However, models of these processes are typically complex, which prevents their incorporation into observational analyses and standard transit spectrum tools. In this work, we develop analytic expressions that allow for the efficient parameterization of forward-scattering and refraction effects in transit spectra. We derive an effective slant optical depth that includes a correction for forward-scattered light, and present an analytic form of this correction. We validate our correction against a full-physics transit spectrum model that includes scattering, and we explore the extent to which the omission of forward-scattering effects may bias models. Also, we verify a common analytic expression for the location of a refractive boundary, which we express in terms of the maximum pressure probed in a transit spectrum. This expression is designed to be easily incorporated into existing tools, and we discuss how the detection of a refractive boundary could help indicate the background atmospheric composition by constraining the bulk refractivity of the atmosphere. Finally, we show that opacity from Rayleigh scattering and collision-induced absorption will outweigh the effects of refraction for Jupiter-like atmospheres whose equilibrium temperatures are above 400-500 K.
International Nuclear Information System (INIS)
Taherkhani, Farid; Akbarzadeh, Hamed; Feyzi, Mostafa; Rafiee, Hamid Reza
2015-01-01
Molecular dynamics simulation has been implemented for doping effect on melting temperature, heat capacity, self-diffusion coefficient of gold–copper bimetallic nanostructure with 55 total gold and copper atom numbers and its bulk alloy. Trend of melting temperature for gold–copper bimetallic nanocluster is not same as melting temperature copper–gold bulk alloy. Molecular dynamics simulation of our result regarding bulk melting temperature is consistence with available experimental data. Molecular dynamics simulation shows that melting temperature of gold–copper bimetallic nanocluster increases with copper atom fraction. Semi-empirical potential model and quantum Sutton–Chen potential models do not change melting temperature trend with copper doping of gold–copper bimetallic nanocluster. Self-diffusion coefficient of copper atom is greater than gold atom in gold–copper bimetallic nanocluster. Semi-empirical potential within the tight-binding second moment approximation as new application potential model for melting temperature of gold–copper bulk structure shows better result in comparison with EAM, Sutton–Chen potential, and quantum Sutton–Chen potential models
GENESIS - The GENEric SImulation System for Modelling State Transitions.
Gillman, Matthew S
2017-09-20
This software implements a discrete time Markov chain model, used to model transitions between states when the transition probabilities are known a priori . It is highly configurable; the user supplies two text files, a "state transition table" and a "config file", to the Perl script genesis.pl. Given the content of these files, the script generates a set of C++ classes based on the State design pattern, and a main program, which can then be compiled and run. The C++ code generated is based on the specification in the text files. Both multiple branching and bi-directional transitions are allowed. The software has been used to model the natural histories of colorectal cancer in Mexico. Although written primarily to model such disease processes, it can be used in any process which depends on discrete states with known transition probabilities between those states. One suitable area may be in environmental modelling. A test suite is supplied with the distribution. Due to its high degree of configurability and flexibility, this software has good re-use potential. It is stored on the Figshare repository.
Dealing with selection bias in educational transition models
DEFF Research Database (Denmark)
Holm, Anders; Jæger, Mads Meier
2011-01-01
This paper proposes the bivariate probit selection model (BPSM) as an alternative to the traditional Mare model for analyzing educational transitions. The BPSM accounts for selection on unobserved variables by allowing for unobserved variables which affect the probability of making educational tr...
A validated, transitional and translational porcine model of hepatocellular carcinoma
Schachtschneider, Kyle M.; Schwind, Regina M.; Darfour-Oduro, Kwame A.; De, Arun K.; Rund, Lauretta A.; Singh, Kuldeep; Principe, Daniel R.; Guzman, Grace; Ray, Charles E.; Ozer, Howard; Gaba, Ron C.; Schook, Lawrence B.
2017-01-01
Difficult questions are confronting clinicians attempting to improve hepatocellular carcinoma (HCC) outcomes. A large animal model with genetic, anatomical, and physiological similarities to humans is required to transition from mouse models to human clinical trials to address unmet clinical
Spin delocalization phase transition in a correlated electrons model
International Nuclear Information System (INIS)
Huerta, L.
1990-11-01
In a simplified one-site model for correlated electrons systems we show the existence of a phase transition corresponding to spin delocalization. The system becomes a solvable model and zero-dimensional functional techniques are used. (author). 7 refs, 3 figs
Baziotis, Ioannis; Kimura, Jun-Ichi; Pantazidis, Avgoustinos; Klemme, Stephan; Berndt, Jasper; Asimow, Paul
2017-04-01
. Observed mineralogy and major element chemistry suggest fractionation in a shallow magma chamber. Using the major element chemistry and PRIMACALC2 (Kimura & Ariskin 2014) back-calculator, inferred crystallization conditions are P=0.02 GPa, oxidized (fO2=QFM+2), and ˜1 wt% H2O in the primary basalt. The source mantle conditions are estimated at P=2.1 GPa, T=1350˚ C, and degree of melting F=8%. We also used trace elements to estimate the incompatible element budget of the primary basalt using the forward trace-element mass-balance model of ARC BASALT SIMULATOR ver.4 (Kimura et al. 2014). Preliminary results suggest that the slab flux was derived from ˜150 km depth, and fluxed mantle melting occurred at P=2.3 GPa, T=1380˚ C, F=8%. The estimated slab depth is consistent with the seismic observations and mantle conditions are consistent with the PRIMACALC2 major element modelling. Our intent is to extend our analytical data with precise trace element and isotope analyses in order to reveal more detailed source conditions and richer information about processes from the slab through the mantle and up to the shallow magma chamber. References Andújar, J. et al. (2015). JPET, 56 (4), 765-794. Druitt, et al. (1999). Geological Society Memoir, 19. Huijsmans, J. P., & Barton, M. (1989). JPET, 30(3), 583-625. Kimura, J. I., & Ariskin, A. A. (2014). G3, 15, 1494-1514. Kimura, J. I. et al. (2014). G3, 15, 691-739. Mortazavi, M., & Sparks, R. S. J. (2004). Con Min Pet, 146(4), 397-413. Papazachos, et al. (2000). Tectonophysics, 319(4), 275-300.
[Estimation of transition probability in diameter grade transition model of forest population].
Qu, Zhilin; Hu, Haiqing
2006-12-01
Based on the theories of statistical analysis and differential equation, two methods were given for estimating the transition probability in the diameter grade transition model of forest population. The first method was used for the estimation when two groups of observation data were given and it was no necessary to consider the environmental factors of forest stand, while the second one was used for that when the environmental factors were known and there was no need of the observation data. The results of case studies showed that both of the two methods had the characteristics of easy operation and high practicability, and the importance of theoretical guidance and practical application in forest management.
The Work of Cultural Transition: An Emerging Model
Directory of Open Access Journals (Sweden)
Tatiana V. Ryba
2016-03-01
Full Text Available In today’s uncertain, fluid job market, transnational mobility has intensified. Though the concept of cultural transition is increasingly used in sport and career research, insight into the processes of how individuals produce their own development through work and relationships in shifting cultural patterns of meaning remains limited. The transnational industry of sports, in which athletes’ psychological adjustment to cultural transitions has implications for both performance and meaningful life, serves as a backdrop for this article. This study applied the life story method to interviews with 15 professional and semi-professional athletes, focusing particularly on the cultural transition aspect of their transnational athletic careers. The aims of the study were to identify the developmental tasks of cultural transitions and strategies/mechanisms through which cultural transitions were enacted. Three underlying mechanisms of the transition process that assisted athletic career adaptability were social repositioning, negotiation of cultural practices, and meaning reconstruction. Based on the data analyses, a temporal model of cultural transition is proposed. The results of this research provide professionals working in the fields of career counseling and migrant support with a content framework for enhancing migrant workers’ adaptabilities and psychological wellbeing.
The Work of Cultural Transition: An Emerging Model.
Ryba, Tatiana V; Stambulova, Natalia B; Ronkainen, Noora J
2016-01-01
In today's uncertain, fluid job market, transnational mobility has intensified. Though the concept of cultural transition is increasingly used in sport and career research, insight into the processes of how individuals produce their own development through work and relationships in shifting cultural patterns of meaning remains limited. The transnational industry of sports, in which athletes' psychological adjustment to cultural transitions has implications for both performance and meaningful life, serves as a backdrop for this article. This study applied the life story method to interviews with 15 professional and semi-professional athletes, focusing particularly on the cultural transition aspect of their transnational athletic careers. The aims of the study were to identify the developmental tasks of cultural transitions and strategies/mechanisms through which cultural transitions were enacted. Three underlying mechanisms of the transition process that assisted athletic career adaptability were social repositioning, negotiation of cultural practices, and meaning reconstruction. Based on the data analyses, a temporal model of cultural transition is proposed. The results of this research provide professionals working in the fields of career counseling and migrant support with a content framework for enhancing migrant workers' adaptabilities and psychological wellbeing.
Numerical modeling of in-vessel melt water interaction in large scale PWR`s
Energy Technology Data Exchange (ETDEWEB)
Kolev, N.I. [Siemens AG, KWU NA-M, Erlangen (Germany)
1998-01-01
This paper presents a comparison between IVA4 simulations and FARO L14, L20 experiments. Both experiments were performed with the same geometry but under different initial pressures, 51 and 20 bar respectively. A pretest prediction for test L21 which is intended to be performed under an initial pressure of 5 bar is also presented. The strong effect of the volume expansion of the evaporating water at low pressure is demonstrated. An in-vessel simulation for a 1500 MW el. PWR is presented. The insight gained from this study is: that at no time are conditions for the feared large scale melt-water intermixing at low pressure in force, with this due to the limiting effect of the expansion process which accelerates the melt and the water into all available flow paths. (author)
A Transitive Model For Artificial Intelligence Applications
Dwyer, John
1986-03-01
A wide range of mathematical techniques have been applied to artificial intelligence problems and some techniques have proved more suitable than others for certain types of problem. We formally define a mathematical model which incorporates some of these successful techniques and we discuss its intrinsic properties. Universal applicability of the model is demonstrated through specific applications to problems drawn from rule-based systems, digital hardware design and constraint satisfaction networks. We also give indications of potential applications to other artificial intelligence problems, including knowledge engineering.
Models of agglomeration and glass transition
Kerner, Richard
2007-01-01
This book is for any physicist interested in new vistas in the domain of non-crystalline condensed matter, aperiodic and quasi-crystalline networks and especially glass physics and chemistry. Students with an elementary background in thermodynamics and statistical physics will find the book accessible. The physics of glasses is extensively covered, focusing on their thermal and mechanical properties, as well as various models leading to the formation of the glassy states of matter from overcooled liquids. The models of agglomeration and growth are also applied to describe the formation of quasicrystals, fullerenes and, in biology, to describe virus assembly pathways.
Human driven transitions in complex model ecosystems
Harfoot, Mike; Newbold, Tim; Tittinsor, Derek; Purves, Drew
2015-04-01
Human activities have been observed to be impacting ecosystems across the globe, leading to reduced ecosystem functioning, altered trophic and biomass structure and ultimately ecosystem collapse. Previous attempts to understand global human impacts on ecosystems have usually relied on statistical models, which do not explicitly model the processes underlying the functioning of ecosystems, represent only a small proportion of organisms and do not adequately capture complex non-linear and dynamic responses of ecosystems to perturbations. We use a mechanistic ecosystem model (1), which simulates the underlying processes structuring ecosystems and can thus capture complex and dynamic interactions, to investigate boundaries of complex ecosystems to human perturbation. We explore several drivers including human appropriation of net primary production and harvesting of animal biomass. We also present an analysis of the key interactions between biotic, societal and abiotic earth system components, considering why and how we might think about these couplings. References: M. B. J. Harfoot et al., Emergent global patterns of ecosystem structure and function from a mechanistic general ecosystem model., PLoS Biol. 12, e1001841 (2014).
Quantum Phase Transition and Universal Dynamics in the Rabi Model.
Hwang, Myung-Joong; Puebla, Ricardo; Plenio, Martin B
2015-10-30
We consider the Rabi Hamiltonian, which exhibits a quantum phase transition (QPT) despite consisting only of a single-mode cavity field and a two-level atom. We prove QPT by deriving an exact solution in the limit where the atomic transition frequency in the unit of the cavity frequency tends to infinity. The effect of a finite transition frequency is studied by analytically calculating finite-frequency scaling exponents as well as performing a numerically exact diagonalization. Going beyond this equilibrium QPT setting, we prove that the dynamics under slow quenches in the vicinity of the critical point is universal; that is, the dynamics is completely characterized by critical exponents. Our analysis demonstrates that the Kibble-Zurek mechanism can precisely predict the universal scaling of residual energy for a model without spatial degrees of freedom. Moreover, we find that the onset of the universal dynamics can be observed even with a finite transition frequency.
Structural transition models for a class or irreversible aggregates
International Nuclear Information System (INIS)
Canessa, E.
1995-02-01
A progress report on two recent theoretical approaches proposed to understand the physics of irreversible fractal aggregates showing up a structural transition from a rather dense to a more multibranched growth is presented. In the first approach the transition is understood by solving the Poisson equation on a squared lattice. The second approach is based on the discretization of the Biharmonic equation. Within these models the transition appears when the growth velocity at the fractal surface presents a minimum. The effects of the surrounding medium and geometrical constraints for the seed particles are considered. By using the optical diffraction method, the structural transition is further characterized by a decrease in the fractal dimension for this peculiar class of aggregates. (author). 17 refs, 4 figs
Advances in transitional flow modeling applications to helicopter rotors
Sheng, Chunhua
2017-01-01
This book provides a comprehensive description of numerical methods and validation processes for predicting transitional flows based on the Langtry–Menter local correlation-based transition model, integrated with both one-equation Spalart–Allmaras (S–A) and two-equation Shear Stress Transport (SST) turbulence models. A comparative study is presented to combine the respective merits of the two coupling methods in the context of predicting the boundary-layer transition phenomenon from fundamental benchmark flows to realistic helicopter rotors. The book will of interest to industrial practitioners working in aerodynamic design and the analysis of fixed-wing or rotary wing aircraft, while also offering advanced reading material for graduate students in the research areas of Computational Fluid Dynamics (CFD), turbulence modeling and related fields.
Generalized transport model for phase transition with memory
International Nuclear Information System (INIS)
Chen, Chi; Ciucci, Francesco
2013-01-01
A general model for phenomenological transport in phase transition is derived, which extends Jäckle and Frisch model of phase transition with memory and the Cahn–Hilliard model. In addition to including interfacial energy to account for the presence of interfaces, we introduce viscosity and relaxation contributions, which result from incorporating memory effect into the driving potential. Our simulation results show that even without interfacial energy term, the viscous term can lead to transient diffuse interfaces. From the phase transition induced hysteresis, we discover different energy dissipation mechanism for the interfacial energy and the viscosity effect. In addition, by combining viscosity and interfacial energy, we find that if the former dominates, then the concentration difference across the phase boundary is reduced; conversely, if the interfacial energy is greater then this difference is enlarged.
A MATLAB GUI to study Ising model phase transition
Thornton, Curtislee; Datta, Trinanjan
We have created a MATLAB based graphical user interface (GUI) that simulates the single spin flip Metropolis Monte Carlo algorithm. The GUI has the capability to study temperature and external magnetic field dependence of magnetization, susceptibility, and equilibration behavior of the nearest-neighbor square lattice Ising model. Since the Ising model is a canonical system to study phase transition, the GUI can be used both for teaching and research purposes. The presence of a Monte Carlo code in a GUI format allows easy visualization of the simulation in real time and provides an attractive way to teach the concept of thermal phase transition and critical phenomena. We will also discuss the GUI implementation to study phase transition in a classical spin ice model on the pyrochlore lattice.
Pommier, A.; Evans, R. L.; Key, K. W.
2011-12-01
We present an investigation of the relation between electrical conductivity (σ) and viscosity (η) of natural melts and its consequences for geophysical data interpretation. Both physicochemical properties are melt structure dependent and are very sensitive to even small changes in temperature and melt composition, including water content. Although many models have been developed for viscosity and for conductivity, attempts to combine both properties are scarce, particularly for complex natural systems. The interpretation of geophysical data can only be as good as our understanding of how physical properties such as conductivity and viscosity vary in the Earth's crust and mantle. Our conductivity-viscosity model is based on the optical basicity of silicate and carbonatitic compositions that count up to 10 oxides. From a structural point of view, the difference between viscosity and conductivity of melts lies in the fact that viscosity is mostly controlled by big network former anions (e.g. SiO44-) and conductivity by the mobility of smaller network modifier cations (e.g. Na+). By classifying each oxide as acidic, basic or amphoteric, optical basicity calculations of melt take into account the influence of forming and modifying species in the melt structure. This modeling approach is supported by recent findings showing that the optical basicity (Λ) of simple synthetic melts (CAS, CMAS systems) can be used to relate conductivity and viscosity [1]. Our model successfully reproduces experimental viscosity and electrical data from the literature over the temperature (T) range [800, 1400°C] by two simple semi-empirical equations in the form σ = f(log η, Λ, 1/T), with R2>0.84 for silicate melts and R2=0.98 for carbonatitic melts. At the scale of the field, the viscosity-conductivity model allows interpretation of conductive anomalies detected through electromagnetic soundings in terms of viscosity. Applications of this model will be presented for specific locations
Amalberti, Julien; Burnard, Pete; Laporte, Didier; Tissandier, Laurent; Neuville, Daniel R.
2016-01-01
Noble gases are ideal probes to study the structure of silicate glasses and melts as the modifications of the silicate network induced by the incorporation of noble gases are negligible. In addition, there are systematic variations in noble gas atomic radii and several noble gas isotopes with which the influence of the network itself on diffusion may be investigated. Noble gases are therefore ideally suited to constrain the time scales of magma degassing and cooling. In order to document noble gas diffusion behavior in silicate glass, we measured the diffusivities of three noble gases (4He, 20Ne and 40Ar) and the isotopic diffusivities of two Ar isotopes (36Ar and 40Ar) in two synthetic basaltic glasses (G1 and G2; 20Ne and 36Ar were only measured in sample G1). These new diffusion results are used to re-interpret time scales of the acquisition of fractionated atmospheric noble gas signatures in pumices. The noble gas bearing glasses were synthesized by exposing the liquids to high noble gas partial pressures at high temperature and pressure (1750-1770 K and 1.2 GPa) in a piston-cylinder apparatus. Diffusivities were measured by step heating the glasses between 423 and 1198 K and measuring the fraction of gas released at each temperature step by noble gas mass spectrometry. In addition we measured the viscosity of G1 between 996 and 1072 K in order to determine the precise glass transition temperature and to estimate network relaxation time scales. The results indicate that, to a first order, that the smaller the size of the diffusing atom, the greater its diffusivity at a given temperature: D(He) > D(Ne) > D(Ar) at constant T. Significantly, the diffusivities of the noble gases in the glasses investigated do not display simple Arrhenian behavior: there are well-defined departures from Arrhenian behavior which occur at lower temperatures for He than for Ne or Ar. We propose that the non-Arrhenian behavior of noble gases can be explained by structural modifications
International Nuclear Information System (INIS)
Peeler, D. K.; Edwards, T. B.
2005-01-01
During the progressive development of the cold cap model (as it applies to a potential melt rate predictive tool), the formation of an Al-Li-silicate phase was identified as an intermediate reaction phase that could possibly hinder melt rate for SB4. To test this theory, six glasses were designed (using Frit 320's composition as the baseline) to maintain a constant 20 wt% sum of alkali content (in frit) by varying Na 2 O to Li 2 O ratios. The Li 2 O concentration ranged from 8 wt% down to 0% in either 2% or 1% increments with the differences being accounted for by an increase in Na 2 O concentration. Although the primary objective of the ''lower Li 2 O'' frits was to evaluate the potential for melt rate improvements, assessments of durability (as measured by the Product Consistency Test (PCT)) were also performed. The results suggest that durable glasses can be produced with these ''lower Li 2 O'' frits should it be necessary to pursue this option for improving melt rate. In addition to the series of glasses to support melt rate assessments, a series of frits were also developed to challenge the current durability model based on the limits proposed by Edwards et al. (2004). Although the ''new'' limits allow access into compositional regions of interest (i.e., higher alkali systems) which can improve melt rate and/or waste loading, there may still be ''additional'' conservatism. In this report, two series of glasses were developed to challenge the ''new'' durability limits for the SB4 system. In the first series, the total alkali of the Frit 320-based glasses (designed to support the melt rate program) was increased from 20 wt% to 21 wt% (in the frit), but the series also evaluated the possible impact of various Na 2 O and Li 2 O mass ratio differences. The second series pushed the alkali limit in the frit even further with frits containing either 22 or 24 wt% total alkali as well as various Na 2 O and Li 2 O mass ratios. The results of the PCT evaluation indicated
Phase transitions for Ising model with four competing interactions
International Nuclear Information System (INIS)
Ganikhodjaev, N.N.; Rozikov, U.A.
2004-11-01
In this paper we consider an Ising model with four competing interactions (external field, nearest neighbor, second neighbors and triples of neighbors) on the Cayley tree of order two. We show that for some parameter values of the model there is phase transition. Our second result gives a complete description of periodic Gibbs measures for the model. We also construct uncountably many non-periodic extreme Gibbs measures. (author)
Analytical expressions for transition edge sensor excess noise models
International Nuclear Information System (INIS)
Brandt, Daniel; Fraser, George W.
2010-01-01
Transition edge sensors (TESs) are high-sensitivity thermometers used in cryogenic microcalorimeters which exploit the steep gradient in resistivity with temperature during the superconducting phase transition. Practical TES devices tend to exhibit a white noise of uncertain origin, arising inside the device. We discuss two candidate models for this excess noise, phase slip shot noise (PSSN) and percolation noise. We extend the existing PSSN model to include a magnetic field dependence and derive a basic analytical model for percolation noise. We compare the predicted functional forms of the noise current vs. resistivity curves of both models with experimental data and provide a set of equations for both models to facilitate future experimental efforts to clearly identify the source of excess noise.
Engineering models of deflagration-to-detonation transition
Energy Technology Data Exchange (ETDEWEB)
Bdzil, J.B.; Son, S.F.
1995-07-01
For the past two years, Los Alamos has supported research into the deflagration-to-detonation transition (DDT) in damaged energetic materials as part of the explosives safety program. This program supported both a theory/modeling group and an experimentation group. The goal of the theory/modeling group was to examine the various modeling structures (one-phase models, two-phase models, etc.) and select from these a structure suitable to model accidental initiation of detonation in damaged explosives. The experimental data on low-velocity piston supported DDT in granular explosive was to serve as a test bed to help in the selection process. Three theoretical models have been examined in the course of this study: (1) the Baer-Nunziato (BN) model, (2) the Stewart-Prasad-Asay (SPA) model and (3) the Bdzil-Kapila-Stewart model. Here we describe these models, discuss their properties, and compare their features.
Elastic properties of silicate melts
DEFF Research Database (Denmark)
Clark, Alisha N.; Lesher, Charles E.
2017-01-01
Low seismic velocity regions in the mantle and crust are commonly attributed to the presence of silicate melts. Determining melt volume and geometric distribution is fundamental to understanding planetary dynamics. We present a new model for seismic velocity reductions that accounts for the anoma......Low seismic velocity regions in the mantle and crust are commonly attributed to the presence of silicate melts. Determining melt volume and geometric distribution is fundamental to understanding planetary dynamics. We present a new model for seismic velocity reductions that accounts...... for the anomalous compressibility of silicate melt, rendering compressional wave velocities more sensitive to melt fraction and distribution than previous estimates. Forward modeling predicts comparable velocity reductions for compressional and shear waves for partially molten mantle, and for low velocity regions...
An Ordered Regression Model to Predict Transit Passengers’ Behavioural Intentions
Energy Technology Data Exchange (ETDEWEB)
Oña, J. de; Oña, R. de; Eboli, L.; Forciniti, C.; Mazzulla, G.
2016-07-01
Passengers’ behavioural intentions after experiencing transit services can be viewed as signals that show if a customer continues to utilise a company’s service. Users’ behavioural intentions can depend on a series of aspects that are difficult to measure directly. More recently, transit passengers’ behavioural intentions have been just considered together with the concepts of service quality and customer satisfaction. Due to the characteristics of the ways for evaluating passengers’ behavioural intentions, service quality and customer satisfaction, we retain that this kind of issue could be analysed also by applying ordered regression models. This work aims to propose just an ordered probit model for analysing service quality factors that can influence passengers’ behavioural intentions towards the use of transit services. The case study is the LRT of Seville (Spain), where a survey was conducted in order to collect the opinions of the passengers about the existing transit service, and to have a measure of the aspects that can influence the intentions of the users to continue using the transit service in the future. (Author)
Ab initio modelling of transition metals in diamond
International Nuclear Information System (INIS)
Watkins, M; Mainwood, A
2003-01-01
Transition metals (TM) from the first transition series are commonly used as solvent catalysts in the synthesis of diamond by high pressure, high temperature processes. Ab initio calculations on these metals, in finite clusters of tetrahedrally coordinated carbon, enable us to investigate trends in their stability and properties. By carrying out systematic studies of interstitial, substitutional and semi-vacancy TM defects, we show that the electronic structure of the TMs is complicated by the presence of 'dangling bonds' when the TM disrupts the crystal lattice: interstitial defects conform to the Ludwig-Woodbury (LW) model, whilst substitutional and semi-vacancy defects move from approximating the LW model early in the transition series to approaching the vacancy model for the heavier metals. Multi-configurational self-consistent field methods allow genuine many-electron states to be modelled; for neutral interstitial, and all substitutional TMs, the crystal fields are found to exceed the exchange energies in strength. Consequently, low spin states are found for these defects. We find substitutional defects to be the most stable, but that semi-vacancy TMs are very similar in energy to the substitutional defects late in the transition series; interstitial defects are only metastable in diamond. Given appropriate charge compensators neutral and positively charged interstitial TM defects were stable, while negatively charged species appeared to be strongly disfavoured
Linearity and Misspecification Tests for Vector Smooth Transition Regression Models
DEFF Research Database (Denmark)
Teräsvirta, Timo; Yang, Yukai
The purpose of the paper is to derive Lagrange multiplier and Lagrange multiplier type specification and misspecification tests for vector smooth transition regression models. We report results from simulation studies in which the size and power properties of the proposed asymptotic tests in small...
On the logical specification of probabilistic transition models
CSIR Research Space (South Africa)
Rens, G
2013-05-01
Full Text Available We investigate the requirements for specifying the behaviors of actions in a stochastic domain. That is, we propose how to write sentences in a logical language to capture a model of probabilistic transitions due to the execution of actions of some...
Long time behaviour of a singular phase transition model
Czech Academy of Sciences Publication Activity Database
Krejčí, Pavel; Sprekels, J.
2006-01-01
Roč. 15, č. 4 (2006), s. 1119-1135 ISSN 1078-0947 Institutional research plan: CEZ:AV0Z10190503 Keywords : phase transition * nonlocal model * integrodifferential heat equation Subject RIV: BA - General Mathematics Impact factor: 1.087, year: 2006
The electroweak phase transition in models with gauge singlets
International Nuclear Information System (INIS)
Ahriche, A.
2007-01-01
A strong first order phase transition is needed for generating the baryon asymmetry; and also to save it during the electroweak phase transition (EWPT). However this condition is not fulfilled within the Standard Model (SM), but in its extensions. It is widely believed that the existence of singlet scalars in some Standard Model extensions can easily make the EWPT strongly first order. In this work, we will examine the strength of the EWPT in the simplest extension of the SM with a real gauge singlet using the sphaleron energy at the critical temperature. We find that the phase transition is stronger by adding a singlet; and also that the criterion for a strong phase transition Ω(T c )/T c >or similar 1, where Ω = (v 2 + (x - x 0 ) 2 ) ( 1)/(2) and x(x 0 ) is the singlet vacuum expectation value in the broken (symmetric) phase, is not valid for models containing singlets, even though often used in the literature. The usual condition v c /T c >or similar 1 is more meaningful, and it is satisfied for the major part of the parameter space for physically allowed Higgs masses. Then it is convenient to study the EWPT in models with singlets that couple only to the Higgs doublets, by replacing the singlets by their vevs. (orig.)
The electroweak phase transition in models with gauge singlets
Energy Technology Data Exchange (ETDEWEB)
Ahriche, A.
2007-04-18
A strong first order phase transition is needed for generating the baryon asymmetry; and also to save it during the electroweak phase transition (EWPT). However this condition is not fulfilled within the Standard Model (SM), but in its extensions. It is widely believed that the existence of singlet scalars in some Standard Model extensions can easily make the EWPT strongly first order. In this work, we will examine the strength of the EWPT in the simplest extension of the SM with a real gauge singlet using the sphaleron energy at the critical temperature. We find that the phase transition is stronger by adding a singlet; and also that the criterion for a strong phase transition {omega}(T{sub c})/T{sub c} >or similar 1, where {omega} = (v{sup 2} + (x - x{sub 0}){sup 2}){sup (}1)/(2) and x(x{sub 0}) is the singlet vacuum expectation value in the broken (symmetric) phase, is not valid for models containing singlets, even though often used in the literature. The usual condition v{sub c}/T{sub c} >or similar 1 is more meaningful, and it is satisfied for the major part of the parameter space for physically allowed Higgs masses. Then it is convenient to study the EWPT in models with singlets that couple only to the Higgs doublets, by replacing the singlets by their vevs. (orig.)
SPOTROD: Semi-analytic model for transits of spotted stars
Béky, Bence
2014-11-01
SPOTROD is a model for planetary transits of stars with an arbitrary limb darkening law and a number of homogeneous, circular spots on their surface. It facilitates analysis of anomalies due to starspot eclipses, and is a free, open source implementation written in C with a Python API.
Employment, Production and Consumption model: Patterns of phase transitions
Czech Academy of Sciences Publication Activity Database
Lavička, H.; Lin, L.; Novotný, Jan
2010-01-01
Roč. 389, č. 8 (2010), s. 1708-1720 ISSN 0378-4371 Institutional research plan: CEZ:AV0Z10480505 Keywords : EPC * Agent based model * Phase transition Subject RIV: BG - Nuclear, Atomic and Molecular Physics, Colliders Impact factor: 1.521, year: 2010
Dasgupta, R.; Ding, S.
2017-12-01
Primitive OIBs can be used to constrain the inventory and heterogeneity of volatile elements such as sulfur (S) in the mantle with potentially large range of mantle potential temperature, TP of 1400-1650 °C and different source lithologies. Yet, no systematic study exists that fully models the extraction of sulfur from a sulfide-bearing heterogeneous mantle relevant for oceanic intraplate magmatism. We modeled the evolution of S and Cu during mantle decompression melting by combining experimental partial melt compositions as a function of P-T and sulfur contents at sulfide saturation (SCSS) models [1, 2]. Calculations at TP =1450-1650 °C to explain S and Cu inventory of near-primary ocean island basalts (OIBs), suggests that partial melts relevant to OIBs have higher SCSS than that of primitive MORBs, because of the positive effect of temperature on SCSS. Hence, for a given sulfide content in the mantle, hotter mantle consumes sulfide more efficiently. Calculation of SCSS along melting adiabats at TP = 1450-1550 °C with variable initial S content of peridotite indicates that sulfide undersaturated primitive Icelandic basalts with 800-950 ppm S and 80-110 ppm Cu can be generated by 10-25 wt.% melting of peridotite containing 100-250 ppm S. However, S and Cu budgets of OIBs that are thought to represent low-degree melts can only be satisfied if equilibration with a sulfide melt with ≥25-30 wt.% Ni is applicable. Alternatively, if Ni content in equilibrium sulfide in peridotitic mantle is ≤20-25 wt.%, mixing of low-degree partial melts of MORB-eclogite and metapelite, with peridotite partial melt is necessary to reconcile the measured S and Cu contents in the low-F (Galapagos, Lau Basin, Loihi and Samoa for TP of 1450-1650 °C. In this latter case, 25-150 ppm S in the peridotite mantle can be exhausted by 1-9 wt.% partial melting. Bulk S content of the heterogeneous mantle source of these islands is high because of the presence of subducted eclogite
Energy Technology Data Exchange (ETDEWEB)
Tripathy, Satya N., E-mail: satyanarayantripathy@gmail.com; Wojnarowska, Zaneta; Knapik, Justyna; Paluch, Marian [Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Silesian Center for Education and Interdisciplinary Research, 75 Pulku Piechoty 1A, 41-500 Chorzow (Poland); Shirota, Hideaki [Department of Nanomaterial Science and Department of Chemistry, Chiba University, 1-33 Yayoi, Inage-ku, Chiba 263-8522 (Japan); Biswas, Ranjit [Department of Chemical, Biological and Macromolecular Sciences, S. N. Bose National Centre for Basic Sciences, JD Block, Sector III, Salt Lake, Kolkata 700098 (India)
2015-05-14
A detailed investigation on the molecular dynamics of ionic deep eutectic solvents (acetamide + lithium nitrate/sodium thiocyanate) is reported. The study was carried out employing dielectric relaxation spectroscopy covering seven decades in frequency (10{sup −1}-10{sup 6} Hz) and in a wide temperature range from 373 K down to 173 K, accessing the dynamic observables both in liquid and glassy state. The dielectric response of the ionic system has been presented in the dynamic window of modulus formalism to understand the conductivity relaxation and its possible connection to the origin of localized motion. Two secondary relaxation processes appear below glass transition temperature. Our findings provide suitable interpretation on the nature of secondary Johari-Goldstein process describing the ion translation and orientation of dipoles in a combined approach using Ngai’s coupling model. A nearly constant loss feature is witnessed at shorter times/lower temperatures. We also discuss the ac conductivity scaling behavior using Summerfield approach and random free energy barrier model which establish the time-temperature superposition principle. These experimental observations have fundamental importance on theoretical elucidation of the conductivity relaxation and glass transition phenomena in molten ionic conductors.
Modeling the Coordinated Operation between Bus Rapid Transit and Bus
Directory of Open Access Journals (Sweden)
Jiaqing Wu
2015-01-01
Full Text Available The coordination between bus rapid transit (BRT and feeder bus service is helpful in improving the operational efficiency and service level of urban public transport system. Therefore, a coordinated operation model of BRT and bus is intended to develop in this paper. The total costs are formulated and optimized by genetic algorithm. Moreover, the skip-stop BRT operation is considered when building the coordinated operation model. A case of the existing bus network in Beijing is studied, the proposed coordinated operation model of BRT and bus is applied, and the optimized headway and costs are obtained. The results show that the coordinated operation model could effectively decrease the total costs of the transit system and the transfer time of passengers. The results also suggest that the coordination between the skip-stop BRT and bus during peak hour is more effective than non-coordination operation.
Application of transition modelling in CFD for use with turbine blades
CSIR Research Space (South Africa)
Dunn, Dwain I
2011-09-01
Full Text Available achieved by the addition of the transition model (as in the boundary layer and Spalart-Allmaras with transition) compared to those without (Yang-shih k-e and Spalart-Allmaras without transition)....
batman: BAsic Transit Model cAlculatioN in Python
Kreidberg, Laura
2015-11-01
I introduce batman, a Python package for modeling exoplanet transit light curves. The batman package supports calculation of light curves for any radially symmetric stellar limb darkening law, using a new integration algorithm for models that cannot be quickly calculated analytically. The code uses C extension modules to speed up model calculation and is parallelized with OpenMP. For a typical light curve with 100 data points in transit, batman can calculate one million quadratic limb-darkened models in 30 seconds with a single 1.7 GHz Intel Core i5 processor. The same calculation takes seven minutes using the four-parameter nonlinear limb darkening model (computed to 1 ppm accuracy). Maximum truncation error for integrated models is an input parameter that can be set as low as 0.001 ppm, ensuring that the community is prepared for the precise transit light curves we anticipate measuring with upcoming facilities. The batman package is open source and publicly available at https://github.com/lkreidberg/batman .
Melting temperature of graphite
International Nuclear Information System (INIS)
Korobenko, V.N.; Savvatimskiy, A.I.
2001-01-01
Full Text: Pulse of electrical current is used for fast heating (∼ 1 μs) of metal and graphite specimens placed in dielectric solid media. Specimen consists of two strips (90 μm in thick) placed together with small gap so they form a black body model. Quasy-monocrystal graphite specimens were used for uniform heating of graphite. Temperature measurements were fulfilled with fast pyrometer and with composite 2-strip black body model up to melting temperature. There were fulfilled experiments with zirconium and tungsten of the same black body construction. Additional temperature measurements of liquid zirconium and liquid tungsten are made. Specific heat capacity (c P ) of liquid zirconium and of liquid tungsten has a common feature in c P diminishing just after melting. It reveals c P diminishing after melting in both cases over the narrow temperature range up to usual values known from steady state measurements. Over the next wide temperature range heat capacity for W (up to 5000 K) and Zr (up to 4100 K) show different dependencies of heat capacity on temperature in liquid state. The experiments confirmed a high quality of 2-strip black body model used for graphite temperature measurements. Melting temperature plateau of tungsten (3690 K) was used for pyrometer calibration area for graphite temperature measurement. As a result, a preliminary value of graphite melting temperature of 4800 K was obtained. (author)
Dissipative phase transition in the open quantum Rabi model
Hwang, Myung-Joong; Rabl, Peter; Plenio, Martin B.
2018-01-01
We demonstrate that the open quantum Rabi model (QRM) exhibits a second-order dissipative phase transition (DPT) and propose a method to observe this transition with trapped ions. The interplay between the ultrastrong qubit-oscillator coupling and the oscillator damping brings the system into a steady state with a diverging number of excitations, in which a DPT is allowed to occur even with a finite number of system components. The universality class of the open QRM, modified from the closed QRM by a Markovian bath, is identified by finding critical exponents and scaling functions using the Keldysh functional integral approach. We propose to realize the open QRM with two trapped ions where the coherent coupling and the rate of dissipation can be individually controlled and adjusted over a wide range. Thanks to this controllability, our work opens a possibility to investigate potentially rich dynamics associated with a dissipative phase transition.
Numerical modeling of the deflagration-to-detonation transition
International Nuclear Information System (INIS)
Forest, C.A.
1978-01-01
The effect of a confined porous bed of burning explosive in contact with a solid explosive is studied by computer simulation. The burning is modeled using a bulk burn model that is a function of the surface area and the pressure. Once pressure excursions occur from the confined burning the transition to detonation is modeled using a pressure-dependent heterogeneous explosive shock decomposition model called Forest Fire. The occurrence of detonation in the solid explosive is shown to be dependent upon the surface-to-volume ratio, the confinement of the porous bed, and the geometry of the system
Absorbing phase transitions in deterministic fixed-energy sandpile models
Park, Su-Chan
2018-03-01
We investigate the origin of the difference, which was noticed by Fey et al. [Phys. Rev. Lett. 104, 145703 (2010), 10.1103/PhysRevLett.104.145703], between the steady state density of an Abelian sandpile model (ASM) and the transition point of its corresponding deterministic fixed-energy sandpile model (DFES). Being deterministic, the configuration space of a DFES can be divided into two disjoint classes such that every configuration in one class should evolve into one of absorbing states, whereas no configurations in the other class can reach an absorbing state. Since the two classes are separated in terms of toppling dynamics, the system can be made to exhibit an absorbing phase transition (APT) at various points that depend on the initial probability distribution of the configurations. Furthermore, we show that in general the transition point also depends on whether an infinite-size limit is taken before or after the infinite-time limit. To demonstrate, we numerically study the two-dimensional DFES with Bak-Tang-Wiesenfeld toppling rule (BTW-FES). We confirm that there are indeed many thresholds. Nonetheless, the critical phenomena at various transition points are found to be universal. We furthermore discuss a microscopic absorbing phase transition, or a so-called spreading dynamics, of the BTW-FES, to find that the phase transition in this setting is related to the dynamical isotropic percolation process rather than self-organized criticality. In particular, we argue that choosing recurrent configurations of the corresponding ASM as an initial configuration does not allow for a nontrivial APT in the DFES.
Vorozhtsov, S.; Minkov, L.; Dammer, V.; Khrustalyov, A.; Zhukov, I.; Promakhov, V.; Vorozhtsov, A.; Khmeleva, M.
2017-12-01
Simulation results for mechanical mixing of aluminum melt using a mixing device are presented. It is found that an increase in the rotational velocity of the vortex device leads to intensive growth of turbulent diffusion in the liquid metal. Small vortices, although energetically weaker, can provide uniform mixing, creating regions of uniformity of several tens of microns. Experimental studies showed that use of a special mechanical mixing device enables injection of course titanium diboride particles and leads to significantly improved microstructure (reduction in average grain size from 900 μm to 400 μm) and mechanical properties of aluminum alloy A356. In particular, introduction of 0.2 wt.% titanium diboride particles using the vortex device leads to an increase in yield strength (from 15 MPa to 65 MPa) and ultimate tensile strength (from 140 MPa to 220 MPa) while preserving the ductility of the alloy ( 4.5%).
Modelling of melting and solidification transport phenomena during hypothetical NPP severe accidents
International Nuclear Information System (INIS)
Sarler, B.
1992-01-01
A physical and mathematical framework to deal with the transport phenomena occuring during melting and solidification of the hypothetical NPP severe accidents is presented. It concentrates on the transient temperature, velocity, and species concentration distributions during such events. The framework is based on the Mixture Continuum Formulation of the components and phases, cast in the boundary-domain integral shape structured by the fundamental solution of the Laplace equation. The formulation could cope with various solid-liquid sub-systems through the inclusion of the specific closure relations. The deduced system of boundary-domain integral equations for conservation of mass, energy, momentum, and species could be solved by the boundary element discrete approximative method. (author) [sl
Chakraborty, I.; Verma, S.; Kumar, B. D.; Boucher, O.
2016-12-01
This study is aimed at mapping the BC distribution and simultaneous detection of the sites prone to become crucial points of major snowmelt runoff in the Hindu Kush Himalayan region (HKH). Prediction of the glacial excess melting phenomenon were anticipated by using the validated modelled estimates of atmospheric mass BC concentration to get a conservative estimate of the BC deposition on snow, which is considered as one of the precursors to excess thawing of the ice. Modelled simulations were validated with respect to measurements carried out at higher altitude (Hanle, NCOP, Satopanth) and lower altitude stations (Nainital, Kullu and Dehradun). Models were found to capture more than 50% of the measured concentration at all higher altitude stations with greater variations of modelled estimates at lower altitudes begetting the need of upgraded retrieval simulation formulation for comparison with the measured estimates. The retrieval simulations narrated a concurrency of 86% to 100% with the measured data at the lower altitudes. At the glacial regions BC deposition as high as 314 µg kg- 1 (range being 150-220 µg kg - 1) corresponding to atmospheric BC mass concentration tends to cause excess snow melt runoff generation. Estimated annual runoff increase (ARI) in the HKH region was observed to be as high as 10%. Snow albedo reduction (SAR), one of the pre-cursors to excess ablation was found to have a range of 10-24%. The simulated trend of BC deposition, ARI and SAR prior to 1961 in the HKH region was stable with no considerable increase in the annual estimated values. Subsequent to 1961, model estimated BC deposition rates and the corresponding estimated SAR depict increase in SAR and ARI for the glaciers in Hindu-Kush Himalayan region. The modelled grids of BC concentration in the region can further be used for better run-off and erosion management.
Compressibility change in iron-rich melt and implications for core formation models
Sanloup, C.; van Westrenen, W.; Dasgupta, R.; Maynard-Casely, H.; Perrillat, J.P.
2011-01-01
Metallic iron, in both solid and liquid states, is the dominant component of Earth's core. Density measurements of molten iron containing an appropriate amount of light elements (5.7. wt.% carbon) identified a liquid-liquid transition by a significant compressibility increase in the vicinity of the
Indian Academy of Sciences (India)
First page Back Continue Last page Overview Graphics. TRANSIT. SYSTEM: DETERMINE 2D-POSITION GLOBALLY BUT INTERMITTENT (POST-FACTO). IMPROVED ACCURACY. PRINCIPLE: POLAR SATELLITES WITH INNOVATIONS OF: GRAVITY-GRADIENT ATTITUDE CONTROL; DRAG COMPENSATION. WORKS ...
Sabin-to-Mahoney Transition Model of Quasispecies Replication
Energy Technology Data Exchange (ETDEWEB)
2009-05-31
Qspp is an agent-based stochastic simulation model of the Poliovirus Sabin-to-Mahoney transition. This code simulates a cell-to-cell model of Poliovirus replication. The model tracks genotypes (virus genomes) as they are replicated in cells, and as the cells burst and release particles into the medium of a culture dish. An inoculum is then taken from the pool of virions and is used to inoculate cells on a new dish. This process repeats. The Sabin genotype comprises the initial inoculum. Nucleotide positions that match the Sabin1 (vaccine strain) and Mahoney (wild type) genotypes, as well as the neurovirulent phenotype (from the literature) are enumerated as constants.
Model for the resistive critical current transition in composite superconductors
International Nuclear Information System (INIS)
Warnes, W.H.
1988-01-01
Much of the research investigating technological type-II superconducting composites relies on the measurement of the resistive critical current transition. We have developed a model for the resistive transition which improves on older models by allowing for the very different nature of monofilamentary and multifilamentary composite structures. The monofilamentary model allows for axial current flow around critical current weak links in the superconducting filament. The multifilamentary model incorporates an additional radial current transfer between neighboring filaments. The development of both models is presented. It is shown that the models are useful for extracting more information from the experimental data than was formerly possible. Specific information obtainable from the experimental voltage-current characteristic includes the distribution of critical currents in the composite, the average critical current of the distribution, the range of critical currents in the composite, the field and temperature dependence of the distribution, and the fraction of the composite dissipating energy in flux flow at any current. This additional information about the distribution of critical currents may be helpful in leading toward a better understanding of flux pinning in technological superconductors. Comparison of the models with several experiments is given and shown to be in reasonable agreement. Implications of the models for the measurement of critical currents in technological composites is presented and discussed with reference to basic flux pinning studies in such composites
International Nuclear Information System (INIS)
Chen Jian; He Lingna; Farson, Dave F; Rokhlin, Stanislav I
2011-01-01
Experiments and particle-in-cell simulations of femtosecond laser-stimulated electrical discharges in submicrometre gaps between scanning tunnelling microscope tip cathodes and gold film anodes are described. In experiments at applied potentials of 35 V and less, discharges were detected either as self-terminating low-current pulses with durations less than 10 ns and magnitudes less than 200 mA or as higher-current, longer-duration current waveforms. The probability of occurrence of low-current pulses increased as applied potential was decreased, being certain at low potentials of 20-25 V. Low-current pulse waveforms and surface melting of gold anodes predicted by the simulations were compared with experiments. Laser stimulation was modelled by introducing partially ionized electrode materials into the simulation domain at a controlled rate. Simulation results showed that the duration of low-current pulses was influenced by the time over which material was added to the gap region, establishing the importance of electrode vaporization on discharge duration. Subsequently, partially ionized electrode materials were preloaded into the gap in controlled amounts in subsequent simulations. Peak currents predicted by these simulations were nearly equal to the low-current pulse measurements but simulated pulse durations were shorter than experiments. Thus, the time axis of simulation current profiles was normalized for equality of charge transfer with experiments. Anode temperatures and melt diameters calculated from normalized simulated heat input profiles were well matched to experimental measurements.
Melocchi, Alice; Parietti, Federico; Maroni, Alessandra; Foppoli, Anastasia; Gazzaniga, Andrea; Zema, Lucia
2016-07-25
Fused deposition modeling (FDM) is a 3D printing technique based on the deposition of successive layers of thermoplastic materials following their softening/melting. Such a technique holds huge potential for the manufacturing of pharmaceutical products and is currently under extensive investigation. Challenges in this field are mainly related to the paucity of adequate filaments composed of pharmaceutical grade materials, which are needed for feeding the FDM equipment. Accordingly, a number of polymers of common use in pharmaceutical formulation were evaluated as starting materials for fabrication via hot melt extrusion of filaments suitable for FDM processes. By using a twin-screw extruder, filaments based on insoluble (ethylcellulose, Eudragit(®) RL), promptly soluble (polyethylene oxide, Kollicoat(®) IR), enteric soluble (Eudragit(®) L, hydroxypropyl methylcellulose acetate succinate) and swellable/erodible (hydrophilic cellulose derivatives, polyvinyl alcohol, Soluplus(®)) polymers were successfully produced, and the possibility of employing them for printing 600μm thick disks was demonstrated. The behavior of disks as barriers when in contact with aqueous fluids was shown consistent with the functional application of the relevant polymeric components. The produced filaments were thus considered potentially suitable for printing capsules and coating layers for immediate or modified release, and, when loaded with active ingredients, any type of dosage forms. Copyright © 2016 Elsevier B.V. All rights reserved.
Comparison of approximations to the transition rate in the DDHMS preequilibrium model
Directory of Open Access Journals (Sweden)
Brito L.
2014-04-01
Full Text Available The double differential hybrid Monte Carlo simulation model (DDHMS originally used exciton model densities and transition densities with approximate angular distributions obtained using linear momentum conservation. Because the model uses only the simplest transition rates, calculations using more complex approximations to these are still viable. We compare calculations using the original approximation to one using a nonrelativistic Fermi gas transition densities with the approximate angular distributions and with exact nonrelativistic and relativistic transition transition densities.
Modelling conditional correlations of asset returns: A smooth transition approach
DEFF Research Database (Denmark)
Silvennoinen, Annastiina; Teräsvirta, Timo
In this paper we propose a new multivariate GARCH model with time-varying conditional correlation structure. The time-varying conditional correlations change smoothly between two extreme states of constant correlations according to a predetermined or exogenous transition variable. An LM-test is d......In this paper we propose a new multivariate GARCH model with time-varying conditional correlation structure. The time-varying conditional correlations change smoothly between two extreme states of constant correlations according to a predetermined or exogenous transition variable. An LM......-test is derived to test the constancy of correlations and LM- and Wald tests to test the hypothesis of partially constant correlations. Analytical expressions for the test statistics and the required derivatives are provided to make computations feasible. An empirical example based on daily return series of ve...
Phase Transitions in a Social Impact Model for Opinion Formation
Bordogna, Clelia M.; Albano, Ezequiel V.
A model for opinion formation in a social group, based on the Theory of Social Impact developed by Latané, is studied by means of numerical simulations. Interactions among the members of the group, as well as with a strong leader competing with the mass media, are considered. The model exhibits first-order transitions between two different states of opinion, which are supported by the leader and the mass media, respectively. The social inertia of the group becomes evident when the opinion of the leader changes periodically. In this case two dynamic states are identified: for long periods of time, the group follows the changes of the leader but, decreasing the period, the opinion of the group remains unchanged. This scenery is suitable for the ocurrence of dynamic phase transitions.
A relativized quark model for radiative baryon transitions
International Nuclear Information System (INIS)
Warns, M.; Schroeder, H.; Pfeil, W.; Rollnik, H.
1989-03-01
In this paper we investigate the electromagnetic form factors of baryons and their resonances using the framework of a relativized constituent quark model. Beyond the usual single-quark transition ansatz, we incorporate relativistic corrections which are well-determined by the intrinsic strong interaction and confinement forces between the quarks. Furthermore we separate off for the compound three-quark system the relativistic center-of-mass motion by an approximately Lorentz-invariant approach. In this way for the first time recoil effects could be explicitly studied. Using the harmonic oscillator wavefunctions with the configuration mixing as derived in the Isgur-Karl model, after restoring gauge invariance our relativized interaction hamiltonian can be used to calculate the transversely and longitudinally polarized photon transition form factors of the baryons. (orig.)
Phase transitions in the sdg interacting boson model
Energy Technology Data Exchange (ETDEWEB)
Van Isacker, P. [Grand Accelerateur National d' Ions Lourds, CEA/DSM-CNRS/IN2P3, BP 55027, F-14076 Caen Cedex 5 (France)], E-mail: isacker@ganil.fr; Bouldjedri, A.; Zerguine, S. [Department of Physics, PRIMALAB Laboratory, University of Batna, Avenue Boukhelouf M El Hadi, 05000 Batna (Algeria)
2010-05-15
A geometric analysis of the sdg interacting boson model is performed. A coherent state is used in terms of three types of deformation: axial quadrupole ({beta}{sub 2}), axial hexadecapole ({beta}{sub 4}) and triaxial ({gamma}{sub 2}). The phase-transitional structure is established for a schematic sdg Hamiltonian which is intermediate between four dynamical symmetries of U(15), namely the spherical U(5)xU(9), the (prolate and oblate) deformed SU{sub {+-}}(3) and the {gamma}{sub 2}-soft SO(15) limits. For realistic choices of the Hamiltonian parameters the resulting phase diagram has properties close to what is obtained in the sd version of the model and, in particular, no transition towards a stable triaxial shape is found.
Methanol Oxidation on Model Elemental and Bimetallic Transition Metal Surfaces
DEFF Research Database (Denmark)
Tritsaris, G. A.; Rossmeisl, J.
2012-01-01
Direct methanol fuel cells are a key enabling technology for clean energy conversion. Using density functional theory calculations, we study the methanol oxidation reaction on model electrodes. We discuss trends in reactivity for a set of monometallic and bimetallic transition metal surfaces, flat...... sites on the surface and to screen for novel bimetallic surfaces of enhanced activity. We suggest platinum copper surfaces as promising anode catalysts for direct methanol fuel cells....
Modelling gait transition in two-legged animals
Pinto, Carla M. A.; Santos, Alexandra P.
2011-12-01
The study of locomotor patterns has been a major research goal in the last decades. Understanding how intralimb and interlimb coordination works out so well in animals' locomotion is a hard and challenging task. Many models have been proposed to model animal's rhythms. These models have also been applied to the control of rhythmic movements of adaptive legged robots, namely biped, quadruped and other designs. In this paper we study gait transition in a central pattern generator (CPG) model for bipeds, the 4-cells model. This model is proposed by Golubitsky, Stewart, Buono and Collins and is studied further by Pinto and Golubitsky. We briefly resume the work done by Pinto and Golubitsky. We compute numerically gait transition in the 4-cells CPG model for bipeds. We use Morris-Lecar equations and Wilson-Cowan equations as the internal dynamics for each cell. We also consider two types of coupling between the cells: diffusive and synaptic. We obtain secondary gaits by bifurcation of primary gaits, by varying the coupling strengths. Nevertheless, some bifurcating branches could not be obtained, emphasizing the fact that despite analytically those bifurcations exist, finding them is a hard task and requires variation of other parameters of the equations. We note that the type of coupling did not influence the results.
Holographic picture of heavy vector meson melting
Energy Technology Data Exchange (ETDEWEB)
Braga, Nelson R.F.; Diles, Saulo [Universidade Federal do Rio de Janeiro, Instituto de Fisica, Rio de Janeiro, RJ (Brazil); Martin Contreras, Miguel Angel [Universidad de los Andes, High Energy Group, Department of Physics, Bogota (Colombia)
2016-11-15
The fraction of heavy vector mesons produced in a heavy ion collision, as compared to a proton-proton collision, serves as an important indication of the formation of a thermal medium, the quark-gluon plasma. This sort of analysis strongly depends on understanding the thermal effects of a medium like the plasma on the states of heavy mesons. In particular, it is crucial to know the temperature ranges where they undergo a thermal dissociation, or melting. AdS/QCD models are know to provide an important tool for the calculation of hadronic masses, but in general are not consistent with the observation that decay constants of heavy vector mesons decrease with excitation level. It has recently been shown that this problem can be overcome using a soft wall background and introducing an extra energy parameter, through the calculation of correlation functions at a finite position of anti-de Sitter space. This approach leads to the evaluation of masses and decay constants of S wave quarkonium states with just one flavor dependent and one flavor independent parameter. Here we extend this more realistic model to finite temperatures and analyze the thermal behavior of the states 1S, 2S and 3S of bottomonium and charmonium. The corresponding spectral function exhibits a consistent picture for the melting of the states where, for each flavor, the higher excitations melt at lower temperatures. We estimate for these six states the energy ranges in which the heavy vector mesons undergo a transition from a well-defined peak in the spectral function to complete melting in the thermal medium. A very clear distinction between the heavy flavors emerges, with the bottomonium state Υ(1S) surviving a deconfinement transition at temperatures much larger than the critical deconfinement temperature of the medium. (orig.)
Employment, Production and Consumption model: Patterns of phase transitions
Lavička, H.; Lin, L.; Novotný, J.
2010-04-01
We have simulated the model of Employment, Production and Consumption (EPC) using Monte Carlo. The EPC model is an agent based model that mimics very basic rules of industrial economy. From the perspective of physics, the nature of the interactions in the EPC model represents multi-agent interactions where the relations among agents follow the key laws for circulation of capital and money. Monte Carlo simulations of the stochastic model reveal phase transition in the model economy. The two phases are the phase with full unemployment and the phase with nearly full employment. The economy switches between these two states suddenly as a reaction to a slight variation in the exogenous parameter, thus the system exhibits strong non-linear behavior as a response to the change of the exogenous parameters.
Rheological Model for Describing Viscometric Flows of Melts of Branched Polymers
Czech Academy of Sciences Publication Activity Database
Merzlikina, D.A.; Pyshnograi, G.; Pivokonský, Radek; Filip, Petr
2016-01-01
Roč. 89, č. 3 (2016), s. 652-659 ISSN 1062-0125 Grant - others:Russian Foundation for Basic Research(RU) 15-4-04003 Institutional support: RVO:67985874 Keywords : rheology * polymer melts * mesoscopic approach * rheological equation of state * viscometric fl ows Subject RIV: BK - Fluid Dynamics http://download.springer.com/static/pdf/8/art%253A10.1007%252Fs10891-016-1423-7.pdf?originUrl=http%3A%2F%2Flink.springer.com%2Farticle%2F10.1007%2Fs10891-016-1423-7&token2=exp=1481193683~acl=%2Fstatic%2Fpdf%2F8%2Fart%25253A10.1007%25252Fs10891-016-1423-7.pdf%3ForiginUrl%3Dhttp%253A%252F%252Flink.springer.com%252Farticle%252F10.1007%252Fs10891-016-1423-7*~hmac=cb34c324456883ecc6fc41d3feb0677836d7c454728829b5e085aac5ce7de417
Rheological Model for Describing Viscometric Flows of Melts of Branched Polymers
Czech Academy of Sciences Publication Activity Database
Merzlikina, D.A.; Pyshnograi, G.; Pivokonský, Radek; Filip, Petr
2016-01-01
Roč. 89, č. 3 (2016), s. 652-659 ISSN 1062-0125 Grant - others:Russian Foundation for Basic Research(RU) 15-4-04003 Institutional support: RVO:67985874 Keywords : rheology * polymer melts * mesoscopic approach * rheological equation of state * viscometric fl ows Subject RIV: BK - Fluid Dynamics http ://download.springer.com/static/pdf/8/art%253A10.1007%252Fs10891-016-1423-7.pdf?originUrl= http %3A%2F%2Flink.springer.com%2Farticle%2F10.1007%2Fs10891-016-1423-7&token2=exp=1481193683~acl=%2Fstatic%2Fpdf%2F8%2Fart%25253A10.1007%25252Fs10891-016-1423-7.pdf%3ForiginUrl%3Dhttp%253A%252F%252Flink.springer.com%252Farticle%252F10.1007%252Fs10891-016-1423-7*~hmac=cb34c324456883ecc6fc41d3feb0677836d7c454728829b5e085aac5ce7de417
Ayala, A.; Pellicciotti, F.; MacDonell, S.; McPhee, J.; Burlando, P.
2017-07-01
We investigate the energy balance and ablation regimes of glaciers in high-elevation, dry environments using glaciometeorological data collected on six glaciers in the semiarid Andes of North-Central Chile (29-34°S, 3127-5324 m). We use a point-scale physically based energy balance (EB) model and an enhanced Temperature-Index (ETI) model that calculates melt rates only as a function of air temperature and net shortwave radiation. At all sites, the largest energy inputs are net shortwave and incoming longwave radiation, which are controlled by surface albedo and elevation, respectively. Turbulent fluxes cancel each other out at the lower sites, but as elevation increases, cold, dry and wind-exposed conditions increase the magnitude of negative latent heat fluxes, associated with large surface sublimation rates. In midsummer (January), ablation rates vary from 67.9 mm w.e. d-1 at the lowest site (˜100% corresponding to melt), to 2.3 mm w.e. d-1 at the highest site (>85% corresponding to surface sublimation). At low-elevation, low-albedo, melt-dominated sites, the ETI model correctly reproduces melt using a large range of possible parameters, but both the performance and parameter transferability decrease with elevation for two main reasons: (i) the air temperature threshold approach for melt onset does not capture the diurnal variability of melt in cold and strong irradiated environments and (ii) energy losses decrease the correlation between melt and net shortwave radiation. We summarize our results by means of an elevation profile of ablation components that can be used as reference in future studies of glacier ablation in the semiarid Andes.
Aravena, A.; Gutiérrez, F. J.; Parada, M. A.; Payacán, Í.; Bachmann, O.; Poblete, F.
2017-07-01
The origin of highly evolved magmas (e.g. rhyolites) has been a long-standing controversy in earth sciences. They are commonly thought to be generated in the upper crust by melt extraction from mush zones, but due to the rapid cooling of magma reservoirs in such shallow and typically cold environments, high magma emplacement rates of intermediate magmas are thought to be necessary to maintain large silicic mushes above the solidus long enough for the high-SiO2 melts extraction to occur. Late-stage redistribution of interstitial melts (i.e. heat and mass) by channels/dikes within those mushes has been invoked as a mechanism to preserve silicic mushes above their solidi for longer periods (i.e. delaying their final crystallization), but the nature of this process and its implications on plutons zonation are still poorly understood. Here, using time-dependent numerical modeling, we study the feasibility of late-stage interstitial melt extraction/redistribution by channels/dikes from a crystalline mush. Our model accounts for magma fluid dynamics, extraction of residual melts and thermal evolution of the crystallizing magma system and its hosting rocks, considering the thermal effect of the redistributing material. The model was applied to explain the anatomy of the well-documented La Gloria pluton (LGP, Central Chile), which exhibits increasing contents of SiO2 and abundant leucocratic dikes toward the margins, interpreted as trapped residual melts generated elsewhere in the magma chamber. Our results suggest that favorable conditions for extracting late-stage residual melts are reached at temperatures of 750 °C (60 vol% crystallinity), at least for compositions similar to LGP dikes. Simulations correspond to 30 kyr of reservoir cooling, when the concentric compositional zonation of LGP is reproduced after a short period of extraction (feed large rhyolitic eruptions, at least once recharges have stopped.
More on the melting of Lennard-Jones clusters
International Nuclear Information System (INIS)
Garzon, I.L.; Avalos-Borja, M.; Blaisten-Barojas, E.
1989-01-01
The melting of 13-atom clusters interacting via Lennard-Jones potentials has been revisited using molecular dynamics coupled to steepest descent quenches. A procedure was devised to account for the fraction of times the global and local minima of the potential energy surface are accessed during a long trajectory. This quantity presents a sigmoid shape. A phenomenological model of melting is given in terms of a correlated walk that maps the short time excursions among the global and local minima in configuration space. Comparison between the simulation results and the theoretical model shows that the melting transition is well described in terms of the temperature changes of the fraction of high energy minima accessed during the cluster trajectory. Cooperativity is clear from the S shape of this quantity, i.e., the access to a local minimum favours the access to other local minima. (orig.)
DEFF Research Database (Denmark)
Gørgens, Tue; Skeels, Christopher L.; Wurtz, Allan
This paper explores estimation of a class of non-linear dynamic panel data models with additive unobserved individual-specific effects. The models are specified by moment restrictions. The class includes the panel data AR(p) model and panel smooth transition models. We derive an efficient set...... of moment restrictions for estimation and apply the results to estimation of panel smooth transition models with fixed effects, where the transition may be determined endogenously. The performance of the GMM estimator, both in terms of estimation precision and forecasting performance, is examined in a Monte...... Carlo experiment. We find that estimation of the parameters in the transition function can be problematic but that there may be significant benefits in terms of forecast performance....
de Smet, J.H.
1999-01-01
This thesis elaborates on the evolution of the continental upper mantle based on numerical modelling results. The descriptive and explanatory basis is formed by a numerical thermo-chemical convection model. The model evolution starts in the early Archaean about 4 billion years ago. The model follows
Smet, J.H. de
1999-01-01
This thesis elaborates on the evolution of the continental upper mantle based on numerical modelling results. The descriptive and explanatory basis is formed by a numerical thermo-chemical convection model. The model evolution starts in the early Archaean about 4 billion years ago. The model
Digital herders and phase transition in a voting model
Energy Technology Data Exchange (ETDEWEB)
Hisakado, M [Standard and Poor' s, Marunouchi 1-6-5, Chiyoda ku, Tokyo 100-0005 (Japan); Mori, S, E-mail: masato_hisakado@standardandpoors.com, E-mail: mori@sci.kitasato-u.ac.jp [Department of Physics, School of Science, Kitasato University, Kitasato 1-15-1, Sagamihara, Kanagawa 228-8555 (Japan)
2011-07-08
In this paper, we discuss a voting model with two candidates, C{sub 1} and C{sub 2}. We set two types of voters-herders and independents. The voting of independent voters is based on their fundamental values; on the other hand, the voting of herders is based on the number of votes. Herders always select the majority of the previous r votes, which are visible to them. We call them digital herders. We can accurately calculate the distribution of votes for special cases. When r {>=} 3, we find that a phase transition occurs at the upper limit of t, where t is the discrete time (or number of votes). As the fraction of herders increases, the model features a phase transition beyond which a state where most voters make the correct choice coexists with one where most of them are wrong. On the other hand, when r < 3, there is no phase transition. In this case, the herders' performance is the same as that of the independent voters. Finally, we recognize the behavior of human beings by conducting simple experiments.
Senese, A.; Maugeri, M.; Vuillermoz, E.; Smiraglia, C.; Diolaiuti, G.
2014-03-01
The glacier melt conditions (i.e.: null surface temperature and positive energy budget) can be assessed by analyzing meteorological and energy data acquired by a supraglacial Automatic Weather Station (AWS). In the case this latter is not present the assessment of actual melting conditions and the evaluation of the melt amount is difficult and simple methods based on T-index (or degree days) models are generally applied. These models require the choice of a correct temperature threshold. In fact, melt does not necessarily occur at daily air temperatures higher than 273.15 K. In this paper, to detect the most indicative threshold witnessing melt conditions in the April-June period, we have analyzed air temperature data recorded from 2006 to 2012 by a supraglacial AWS set up at 2631 m a.s.l. on the ablation tongue of the Forni Glacier (Italian Alps), and by a weather station located outside the studied glacier (at Bormio, a village at 1225 m a.s.l.). Moreover we have evaluated the glacier energy budget and the Snow Water Equivalent (SWE) values during this time-frame. Then the snow ablation amount was estimated both from the surface energy balance (from supraglacial AWS data) and from T-index method (from Bormio data, applying the mean tropospheric lapse rate and varying the air temperature threshold) and the results were compared. We found that the mean tropospheric lapse rate permits a good and reliable reconstruction of glacier air temperatures and the major uncertainty in the computation of snow melt is driven by the choice of an appropriate temperature threshold. From our study using a 5.0 K lower threshold value (with respect to the largely applied 273.15 K) permits the most reliable reconstruction of glacier melt.
Human Inferences about Sequences: A Minimal Transition Probability Model.
Directory of Open Access Journals (Sweden)
Florent Meyniel
2016-12-01
Full Text Available The brain constantly infers the causes of the inputs it receives and uses these inferences to generate statistical expectations about future observations. Experimental evidence for these expectations and their violations include explicit reports, sequential effects on reaction times, and mismatch or surprise signals recorded in electrophysiology and functional MRI. Here, we explore the hypothesis that the brain acts as a near-optimal inference device that constantly attempts to infer the time-varying matrix of transition probabilities between the stimuli it receives, even when those stimuli are in fact fully unpredictable. This parsimonious Bayesian model, with a single free parameter, accounts for a broad range of findings on surprise signals, sequential effects and the perception of randomness. Notably, it explains the pervasive asymmetry between repetitions and alternations encountered in those studies. Our analysis suggests that a neural machinery for inferring transition probabilities lies at the core of human sequence knowledge.
Brown, M. E.; Racoviteanu, A. E.; Tarboton, D. G.; Sen Gupta, A.; Nigro, J.; Policelli, F.; Habib, S.; Tokay, M.; Shrestha, M. S.; Bajracharya, S.
2014-01-01
Quantification of the contribution of the hydrologic components (snow, ice and rain) to river discharge in the Hindu Kush Himalayan (HKH) region is important for decision-making in water sensitive sectors, and for water resources management and flood risk reduction. In this area, access to and monitoring of the glaciers and their melt outflow is challenging due to difficult access, thus modeling based on remote sensing offers the potential for providing information to improve water resources management and decision making. This paper describes an integrated modeling system developed using downscaled NASA satellite based and earth system data products coupled with in-situ hydrologic data to assess the contribution of snow and glaciers to the flows of the rivers in the HKH region. Snow and glacier melt was estimated using the Utah Energy Balance (UEB) model, further enhanced to accommodate glacier ice melt over clean and debris-covered tongues, then meltwater was input into the USGS Geospatial Stream Flow Model (Geo- SFM). The two model components were integrated into Better Assessment Science Integrating point and Nonpoint Sources modeling framework (BASINS) as a user-friendly open source system and was made available to countries in high Asia. Here we present a case study from the Langtang Khola watershed in the monsoon-influenced Nepal Himalaya, used to validate our energy balance approach and to test the applicability of our modeling system. The snow and glacier melt model predicts that for the eight years used for model evaluation (October 2003-September 2010), the total surface water input over the basin was 9.43 m, originating as 62% from glacier melt, 30% from snowmelt and 8% from rainfall. Measured streamflow for those years were 5.02 m, reflecting a runoff coefficient of 0.53. GeoSFM simulated streamflow was 5.31 m indicating reasonable correspondence between measured and model confirming the capability of the integrated system to provide a quantification
Model Atmospheres and Transit Spectra for Hot Rocky Planets
Lupu, Roxana
We propose to build a versatile set of self-consistent atmospheric models for hot rocky exoplanets and use them to predict their transit and eclipse spectra. Hot rocky exoplanets will form the majority of small planets in close-in orbits to be discovered by the TESS and Kepler K2 missions, and offer the best opportunity for characterization with current and future instruments. We will use fully non-grey radiative-convective atmospheric structure codes with cloud formation and vertical mixing, combined with a self-consistent treatment of gas chemistry above the magma ocean. Being in equilibrium with the surface, the vaporized rock material can be a good tracer of the bulk composition of the planet. We will derive the atmospheric structure and escape rates considering both volatile-free and volatile bearing compositions, which reflect the diversity of hot rocky planet atmospheres. Our models will inform follow- up observations with JWST and ground-based instruments, aid the interpretation of transit and eclipse spectra, and provide a better understanding of volatile loss in these atmospheres. Such results will help refine our picture of rocky planet formation and evolution. Planets in ultra-short period (USP) orbits are a special class of hot rocky exoplanets. As shown by Kepler, these planets are generally smaller than 2 Earth radii, suggesting that they are likely to be rocky and could have lost their volatiles through photo-evaporation. Being close to their host stars, these planets are ultra-hot, with estimated temperatures of 1000-3000 K. A number of USP planets have been already discovered (e.g. Kepler-78 b, CoRoT-7 b, Kepler-10 b), and this number is expected to grow by confirming additional planet candidates. The characterization of planets on ultra-short orbits is advantageous due to the larger number of observable transits, and the larger transit signal in the case of an evaporating atmosphere. Much advance has been made in understanding and characterizing
Modeling Io volcanism: Maximum volcanic temperatures, depths of melting and magma composition
Crumpler, L. S.; Strom, R. G.
1984-01-01
Interim results of thermal and structural modeling of volcanism on Io were presented. The final results of the modeling are summarized. The basic analysis is an evaluation of the magma trigger mechanism for initiating and maintaining eruptions. Secondary aspects include models of the mechanical mode of magma emplacement, interactions with a sulphur-rich upper crust, and more speculative implications for Io's volcanism.
Physical and mathematical modelling of gas-fired glass melting furnaces with regard to NO-formation
International Nuclear Information System (INIS)
May, F.; Stuchlik, O.; Kremer, H.
1999-01-01
The increasing demand in quality, efficiency, energy conservation and the environmental issues drive the operators of high temperature processes to optimize their furnaces. Especially the glass manufacturing industry with their high working temperatures from about 1850 K to more than 1950 K and high air preheating temperatures of above 1480 K will produce high NOx-concentrations in the flue gas if no primary measures are taken. Considering the three different paths for NO-formation it is obvious that increased thermal NO is responsible for higher emissions. The German environmental regulations on air ''TA Luft'' requires a maximum value of 500 mg/mN3 in the flue gas for most of the combustion processes but for glass melting furnaces a temporary regulation of 1200 mg/mN3 and further on to 800 mg/mN3 is valid. Due to economical reasons the level of secondary measures is to be minimized thus the main objective of research is to reduce the NOx-emissions via primary measures. The design of the furnace is very important due to its strong influence on the distribution of velocity and species. That consequently affects the temperature field and the heat transfer to the load and further on the emissions. For the understanding of the processes within these furnaces numerical simulations, which are successfully validated with experiments, can give valuable indications to optimize furnace design for the reduction of NOx-emissions. The glass melting furnace modelled here is a regenerative horseshoe furnace fired with natural gas. Combustion air is preheated within the regenerator onto a level of temperature of 1650 K. (author)
Hysteretic transitions in the Kuramoto model with inertia
Torcini, Alessandro; Olmi, Simona; Navas, Adrian; Boccaletti, Stefano
2015-03-01
We report finite size numerical investigations and mean field analysis of a Kuramoto model with inertia for fully coupled and diluted systems. In particular, we examine the transition from incoherence to coherence for increasingly large system size and inertia. For sufficiently large inertia the transition is hysteretic and within the hysteretic region clusters of locked oscillators of various sizes and different levels of synchronization coexist. A modification of the mean field theory developed by Tanaka, Lichtenberg, and Oishi allows to derive the synchronization curve associated to each of these clusters. We have also investigated numerically the limits of existence of the coherent and of the incoherent solutions. The minimal coupling required to observe the coherent state is largely independent of the system size and it saturates to a constant value already for moderately large inertia values. The incoherent state is observable up to a critical coupling whose value saturates for large inertia and for finite system sizes, while in the thermodinamic limit this critical value diverges proportionally to the mass. By increasing the inertia the transition becomes more complex, and the synchronization occurs via the emergence of clusters of coherently drifting oscillators. Financial support has been provided by the Italian Ministry of University and Research within the project CRISIS LAB PNR 2011-2013.
Sildenafil normalizes bowel transit in preclinical models of constipation.
Directory of Open Access Journals (Sweden)
Sarah K Sharman
Full Text Available Guanylyl cyclase-C (GC-C agonists increase cGMP levels in the intestinal epithelium to promote secretion. This process underlies the utility of exogenous GC-C agonists such as linaclotide for the treatment of chronic idiopathic constipation (CIC and irritable bowel syndrome with constipation (IBS-C. Because GC-C agonists have limited use in pediatric patients, there is a need for alternative cGMP-elevating agents that are effective in the intestine. The present study aimed to determine whether the PDE-5 inhibitor sildenafil has similar effects as linaclotide on preclinical models of constipation. Oral administration of sildenafil caused increased cGMP levels in mouse intestinal epithelium demonstrating that blocking cGMP-breakdown is an alternative approach to increase cGMP in the gut. Both linaclotide and sildenafil reduced proliferation and increased differentiation in colon mucosa, indicating common target pathways. The homeostatic effects of cGMP required gut turnover since maximal effects were observed after 3 days of treatment. Neither linaclotide nor sildenafil treatment affected intestinal transit or water content of fecal pellets in healthy mice. To test the effectiveness of cGMP elevation in a functional motility disorder model, mice were treated with dextran sulfate sodium (DSS to induce colitis and were allowed to recover for several weeks. The recovered animals exhibited slower transit, but increased fecal water content. An acute dose of sildenafil was able to normalize transit and fecal water content in the DSS-recovery animal model, and also in loperamide-induced constipation. The higher fecal water content in the recovered animals was due to a compromised epithelial barrier, which was normalized by sildenafil treatment. Taken together our results show that sildenafil can have similar effects as linaclotide on the intestine, and may have therapeutic benefit to patients with CIC, IBS-C, and post-infectious IBS.
Vortex lattice melting, pinning and kinetics
International Nuclear Information System (INIS)
Doniach, S.; Ryu, S.; Kapitulnik, A.
1994-01-01
The phenomenology of the high T c superconductors is discussed both at the level of the thermodynamics of melting of the Abrikosov flux lattice and in terms of the melting and kinetics of the flux lattice for a pinned system. The authors review results on 3D melting obtained by a Monte Carlo simulation approach in which the 2D open-quotes pancakeclose quotes vortices are treated as statistical variables. The authors discuss pinning in the context of the strong pinning regime in which the vortex density given in terms of the applied field B is small compared to that represented by an effective field B pin measuring the pinning center density. The authors introduce a new criterion for the unfreezing of a vortex glass on increase of magnetic field or temperature, in the strong pinning, small field unit. The authors model this limit in terms of a single flux line interacting with a columnar pin. This model is studied both analytically and by computer simulation. By applying a tilt potential, the authors study the kinetics of the vortex motion in an external current and show that the resulting current-voltage characteristic follows a basic vortex glass-like scaling relation in the vicinity of the depinning transition
E1 transitions in the Harari quark model
International Nuclear Information System (INIS)
Kamath, S.G.
1976-10-01
The radiative decays psi(3.684)→γchi(sup(3)P sub(J)) and chi(sup(3)Psub(J)→chipsi(3.1) have been analyzed within the framework of the Harari quark model. The spatial matrix elements describing these L=1 to L=0 transitions have been estimated from the A 2 (1310)→ chirho(770) mode by applying U(6) symmetry at the quark level. The resulting decay widths, which compare very well with experimental data, have subsequently been used to determine the SU(3)sub(H) assignments for the chi states
Predictors of stage transitions in the precaution adoption process model.
de Vet, Emely; de Nooijer, Jascha; Oenema, Anke; de Vries, Nanne K; Brug, Johannes
2008-01-01
To explore psychosocial correlates and predictors of stage transitions in the precaution adoption process model (PAPM) for fruit intake. A cohort completed three electronic questionnaires, at baseline (time 0), 35 days later (time 1), and another 32 days later (time 2). Secured Internet Web site. A cohort of 735 adults was formed from a random sample of an existing Internet panel. The mean age was 37.5 years, 51% were women, and 90% were of Dutch origin. Most respondents (48%) had a medium level of education. Precaution adoption process model stage, risk perception, perception of own fruit intake level, attitude, pros, cons, subjective norms, social support, modeling, self-efficacy, and fruit intake (assessed using a food frequency questionnaire). Cross-sectional differences in psychosocial variables and fruit intake across PAPM stages at baseline were analyzed using analysis of variance with Tukey multiple comparisons tests. Predictors of PAPM stage transitions between time 0 and time 1 and between time 1 and time 2 were analyzed using logistic regression analysis. Factors related to attitude and social influences may be important if one is to decide to act, whereas strong self-efficacy may also be required for acting on the decision to act. Although the results should be replicated in a larger and more representative sample, the PAPM seems a good framework for studying fruit intake.
A dynamic phase transition model for spatial agglomeration processes.
Weidlich, W; Haag, G
1987-11-01
A nonlinear model of population migration is presented in order to provide a dynamic explanation for the formation of metropolitan areas. "In Section 2 the model is introduced in terms of the rate equations for the mean values of the regional population numbers with specifically chosen individual transition rates. Section 3 gives a survey of concepts and results for the convenience of the reader not interested in the details of the mathematical derivations. Section 4 derives the stationary solutions of the rate equations, that is, the equilibria of the system. Section 5 treats the time dependent solutions of the model equations focussing on the exact analytic solutions along so-called symmetry paths. Section 6 analyzes the dynamic stability of the symmetry path solutions and decides which stationary states are unstable and which are stable equilibrium states." excerpt
A model of interacting strings and the Hagedorn phase transition
International Nuclear Information System (INIS)
Lizzi, F.; Senda, I.
1990-03-01
In this letter we introduce a model of interacting string in which the usual ideal gas approximations are not made. The model is constructed in analogy with nucleation models, the formation of droplets in a supersaturate gas. We consider the strings to be interacting and their number not fixed. The equilibrium configuration is the one for which the time derivatives of the number of strings in the various energies vanishes. We evaluate numerically the equilibrium configurations for various values of the energy density. We find that a density of order one in planck units there is a sharp transition, from a 'gas' phase in which there are many strings, all in the massless or first few excited states, to a 'liquid' phase in which all strings have coalesced into one (or few) highly excited string. (author). 14 refs, 4 figs
Czocher, Jennifer A.
2016-01-01
This study contributes a methodological tool to reconstruct the cognitive processes and mathematical activities carried out by mathematical modelers. Represented as Modeling Transition Diagrams (MTDs), individual modeling routes were constructed for four engineering undergraduate students. Findings stress the importance and limitations of using…
Directory of Open Access Journals (Sweden)
FengBo Li
Full Text Available Development of an ideal marker system facilitates a better understanding of the genetic diversity in lepidopteran non-model organisms, which have abundant species, but relatively limited genomic resources. Single nucleotide polymorphisms (SNPs discovered within single-copy genes have proved to be desired markers, but SNP genotyping by current techniques remain laborious and expensive. High resolution melting (HRM curve analysis represents a simple, rapid and inexpensive genotyping method that is primarily confined to clinical and diagnostic studies. In this study, we evaluated the potential of HRM analysis for SNP genotyping in the lepidopteran non-model species Ostrinia furnacalis (Crambidae. Small amplicon and unlabeled probe assays were developed for the SNPs, which were identified in 30 females of O. furnacalis from 3 different populations by our direct sequencing. Both assays were then applied to genotype 90 unknown female DNA by prior mixing with known wild-type DNA. The genotyping results were compared with those that were obtained using bi-directional sequencing analysis. Our results demonstrated the efficiency and reliability of the HRM assays. HRM has the potential to provide simple, cost-effective genotyping assays and facilitates genotyping studies in any non-model lepidopteran species of interest.
Pai, Tzu-Yi; Lin, Kae-Long; Shie, Je-Lung; Chang, Tien-Chin; Chen, Bor-Yann
2011-03-01
A grey model (GM) and an artificial neural network (ANN) were employed to predict co-melting temperature of municipal solid waste incinerator (MSWI) fly ash and sewage sludge ash (SSA) during formation of modified slag. The results indicated that in the aspect of model prediction, the mean absolute percentage error (MAPEs) were between 1.69 and 13.20% when adopting seven different GM (1, N) models. The MAPE were 1.59 and 1.31% when GM (1, 1) and rolling grey model (RGM (1, 1)) were adopted. The MAPEs fell within the range of 0.04 and 0.50% using different types of ANN. In GMs, the MAPE of 1.31% was found to be the lowest when using RGM (1, 1) to predict co-melting temperature. This value was higher than those of ANN2-1 to ANN8-1 by 1.27, 1.25, 1.24, 1.18, 1.16, 1.14 and 0.81%, respectively. GM only required a small amount of data (at least four data). Therefore, GM could be applied successfully in predicting the co-melting temperature of MSWI fly ash and SSA when no sufficient information is available. It also indicates that both the composition of MSWI fly ash and SSA could be applied on the prediction of co-melting temperature.
FTR power-to-melt study. Phase I. Evaluation of deterministic models
International Nuclear Information System (INIS)
1978-09-01
SIEX is an HEDL fuel thermal performance code. It is designed to be a fast running code for steady state thermal performance analysis of coolant, cladding and fuel temperature throughout the history of a fuel element. The need to have a good predictive model coupled with short running time in the probabilistic analysis has made SIEX one of the potential deterministic models to be adopted. The probabilistic code to be developed will be a general thermal performance code acceptable on a national basis. It is, therefore, necessary to ensure that the physical model meets the requirements of an analytical tool. Since SIEX incorporates some physically-based correlated models, its general validity and limitations should be evaluated before being adopted
Demographic model of the Neolithic transition in Central Europe
Directory of Open Access Journals (Sweden)
Patrik Galeta
2009-12-01
Full Text Available Several recent lines of evidence indicate more intensive contact between LBK farmers and indigenous foragers in Central Europe (5600–5400 calBC. Strong continuity has been identified between Mesolithic and Neolithic material cultures; faunal assemblages, and isotopic analyses of diet have revealed a greater role of hunting in LBK communities; genetic analyses have suggested that the modern Central European gene pool is mainly of Palaeolithic origin. Surprisingly little attention has been paid to demographic aspects of the Neolithic transition. In our study, demographic simulations were performed to assess the demographic conditions that would allow LBK farmers to spread across central Europe without any admixture with Mesolithic foragers. We constructed a stochastic demographic model of changes in farming population size. Model parameters were constrained by data from human demography, archaeology, and human ecology. Our results indicate that the establishment of farming communities in Central Europe without an admixture with foragers was highly improbable. The demographic conditions necessary for colonization were beyond the potential of the Neolithic population. Our study supports the integrationists’ view of the Neolithic transition in Central Europe.
Systematic review: Health care transition practice service models.
Betz, Cecily L; O'Kane, Lisa S; Nehring, Wendy M; Lobo, Marie L
2016-01-01
Nearly 750,000 adolescents and emerging adults with special health care needs (AEA-SHCN) enter into adulthood annually. The linkages to ensure the seamless transfer of care from pediatric to adult care and transition to adulthood for AEA-SHCN have yet to be realized. The purpose of this systematic review was to investigate the state of the science of health care transition (HCT) service models as described in quantitative investigations. A four-tier screening approach was used to obtain reviewed articles published from 2004 to 2013. A total of 17 articles were included in this review. Transfer of care was the most prominent intervention feature. Overall, using the Effective Public Health Practice Project criteria, the studies were rated as weak. Limitations included lack of control groups, rigorous designs and methodology, and incomplete intervention descriptions. As the findings indicate, HCT is an emerging field of practice that is largely in the exploratory stage of model development. Copyright © 2016 Elsevier Inc. All rights reserved.
Directory of Open Access Journals (Sweden)
Massimiliano Tirone
2017-10-01
Full Text Available The complex process of melting in the Earth's interior is studied by combining a multiphase numerical flow model with the program AlphaMELTS which provides a petrological description based on thermodynamic principles. The objective is to address the fundamental question of the effect of the mantle and melt dynamics on the composition and abundance of the melt and the residual solid. The conceptual idea is based on a 1-D description of the melting process that develops along an ideal vertical column where local chemical equilibrium is assumed to apply at some level in space and time. By coupling together the transport model and the chemical thermodynamic model, the evolution of the melting process can be described in terms of melt distribution, temperature, pressure and solid and melt velocities but also variation of melt and residual solid composition and mineralogical abundance at any depth over time. In this first installment of a series of three contributions, a two-phase flow model (melt and solid assemblage is developed under the assumption of complete local equilibrium between melt and a peridotitic mantle (dynamic equilibrium melting, DEM. The solid mantle is also assumed to be completely dry. The present study addresses some but not all the potential factors affecting the melting process. The influence of permeability and viscosity of the solid matrix are considered in some detail. The essential features of the dynamic model and how it is interfaced with AlphaMELTS are clearly outlined. A detailed and explicit description of the numerical procedure should make this type of numerical models less obscure. The general observation that can be made from the outcome of several simulations carried out for this work is that the melt composition varies with depth, however the melt abundance not necessarily always increases moving upwards. When a quasi-steady state condition is achieved, that is when melt abundance does not varies significantly
Census Model Transition: Contributions to its Implementation in Portugal
Directory of Open Access Journals (Sweden)
Dias Carlos A.
2016-03-01
Full Text Available Given the high cost and complexity of traditional censuses, some countries have started to change the census process. Following this trend, Portugal is also evaluating a new census model as an alternative to an exhaustive collection of all statistical units. The main motivations for the implementation of this census model transition in Portugal are related to the decrease in statistical burden on citizens, improvements in the frequency of outputs, and the reduction of collection costs associated with census operations. This article seeks to systematise and critically review all alternatives to the traditional census methodologies, presenting their advantages and disadvantages and the countries that use them. As a result of the comparison, we conclude that the methods that best meet these objectives are those that use administrative data, either in whole or in part. We also present and discuss the results of an inventory and evaluation of administrative registers in Portugal with the potential to produce statistical census information.
Dynamics of the oil transition: Modeling capacity, depletion, and emissions
International Nuclear Information System (INIS)
Brandt, Adam R.; Plevin, Richard J.; Farrell, Alexander E.
2010-01-01
The global petroleum system is undergoing a shift to substitutes for conventional petroleum (SCPs). The Regional Optimization Model for Emissions from Oil Substitutes, or ROMEO, models this oil transition and its greenhouse gas impacts. ROMEO models the global liquid fuel market in an economic optimization framework, but in contrast to other models it solves each model year sequentially, with investment and production optimized under uncertainty about future prevailing prices or resource quantities. ROMEO includes more hydrocarbon resource types than integrated assessment models of climate change. ROMEO also includes the carbon intensities and costs of production of these resources. We use ROMEO to explore the uncertainty of future costs, emissions, and total fuel production under a number of scenarios. We perform sensitivity analysis on the endowment of conventional petroleum and future carbon taxes. Results show incremental emissions from production of oil substitutes of ∼ 0-30 gigatonnes (Gt) of carbon over the next 50 years (depending on the carbon tax). Also, demand reductions due to the higher cost of SCPs could reduce or eliminate these increases. Calculated emissions are highly sensitive to the endowment of conventional oil and less sensitive to a carbon tax. (author)
DEFF Research Database (Denmark)
Zubov, Alexandr; Sin, Gürkan
2018-01-01
Abstract Poly(L-lactic acid) (PLLA) is a fully biodegradable bioplastic with promising market potential. The paper deals with systematic development and analysis of the modeling framework allowing direct mapping between PLLA production process conditions and rheological properties of the polymer ...
Phase Behavior of Semiflexible-Flexible Diblock Copolymer Melt: Insight from Mesoscale Modeling.
Czech Academy of Sciences Publication Activity Database
Beránek, P.; Posel, Zbyšek
2016-01-01
Roč. 16, č. 8 (2016), s. 7832-7835 ISSN 1533-4880 R&D Projects: GA MŠk(CZ) LH12020 Institutional support: RVO:67985858 Keywords : conformational asymmetry * dissipative particle dynamics * mesoscale modeling Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 1.483, year: 2016
Temperature thresholds for degree-day modelling of Greenland ice sheet melt rates
van den Broeke, M.R.; Bus, C.; Ettema, J.; Smeets, P.
2010-01-01
[1] Degree‐day factors (DDFs) are calculated for the ice sheet ablation zone in southwest Greenland, using measurements of automatic weather stations and a regional atmospheric climate model. The rapid increase of DDFs for snow and ice towards higher elevations is caused by the increasing dominance
Simulation of gel phase formation and melting in lipid bilayers using a coarse grained model
Marrink, SJ; Risselada, J; Mark, AE
The transformation between a gel and a fluid phase in dipalmitoyl-phosphatidylcholine (DPPC) bilayers has been simulated using a coarse grained (CG) model by cooling bilayer patches composed of up to 8000 lipids. The critical step in the transformation process is the nucleation of a gel cluster
Aleksić, Ivana; Đuriš, Jelena; Ibrić, Svetlana; Parojčić, Jelena
2015-12-30
Melt granulation in fluid bed processors is an emerging technique, but literature data regarding the modeling of this granulation method are lacking. In the present study different techniques (response surface analysis, multilayer perceptron neural network, and partial least squares method) were applied for modeling of spray-on fluidized bed melt granulation. Experiments were organized in line with central composite design. The effect of binder content and spray air pressure on granule properties was evaluated. The results obtained indicate that binder content can be identified as a critical factor controlling the granule size and size distribution. It was found that agglomeration mechanism involved, i.e., granule shape, can be greatly influenced by binder properties. The spray air pressure was identified as critical process parameter affecting granule flowability. The results presented indicate that application of in silico tools enables enhanced understanding and better control of novel pharmaceutical processes, such as melt granulation in fluidized bed. The artificial neural networks and partial least squares method were found to be superior to response surface methodology in prediction of granule properties. According to the results obtained, application of more advanced empirical modeling techniques complementary to design of experiments can be a suitable approach in defining the design space and optimization of spray-on fluidized bed melt granulation. Copyright © 2015 Elsevier B.V. All rights reserved.
Wi, S.; Yang, Y. C. E.; Khalil, A.
2014-12-01
Glacier and snow melting is main source of water supply making a large contribution to streamflow of major river basins in the Greater Himalaya region including the Syr Darya, the Amu Darya, the Indus, the Ganges and the Brahmaputra basins. Due to the critical role of glacier and snow melting as water supply for both food production and hydropower generation in the region (especially during the low flow season), it is important to evaluate the vulnerability of snow and glacier melting streamflow to different climate conditions. In this study, a distributed glacio-hydrologic model with high resolution climate input is developed and calibrated that explicitly simulates all major hydrological processes and the glacier and snow dynamics for area further discretized by elevation bands. The distributed modeling structure and the glacier and snow modules provide a better understanding about how temperature and precipitation alterations are likely to affect current glacier ice reserves. Climate stress test is used to explore changes in the total streamflow change, snow/glacier melting contribution and glacier accumulation and ablation under a variety of different temperature and precipitation conditions. The latest future climate projections provided from the World Climate Research Programme's Coupled Model Intercomparison Project Phase 5 (CMIP5) is used to inform the possibility of different climate conditions.
Vetter, Scott K.; Shervais, John W.
1993-01-01
Early studies of mare basalts from the Apollo 15 site established that two distinct groups are represented: the olivine-normative basalts (ONB) and the quartz-normative basalts (QNB). The ONB and QNB suites are distinguished petrographically by their phenocryst assemblages (the ONB's are olivine-phyric, the QNB's are generally pyroxene-phyric) and chemically by their major element compositions: the QNB's are higher in SiO2 and MgO/FeO, and lower in FeO and TiO2 than ONB's with similar MgO contents. Experimental data show that the QNB suite is derived from a more magnesian, olivine-normative parent magma, a conclusion which is supported by the recent discovery of high-SiO2 olivine-normative basalt clasts in breccia 15498. The high-SiO2 ONB's fall on olivine control lines with primitive QNB's, and least-squares mixing calculations are consistent with the high-SiO2 ONB's being parental to the more evolved QNB suite. These high-SiO2 ONB's are included as part of the 'QNB suite'. Our major element modeling results also are consistent with the conclusions of earlier studies which showed that the ONB and QNB suites cannot be related to one another by low pressure crystal fractionation. The combination of high Mg#, high SiO2, and low TiO2 in the QNB suite precludes a relationship to the ONB suite by simple removal of liquidus minerals (olivine and pigeonite). Despite these significant differences in petrography and major element composition, both groups have nearly identical trace element concentrations and chondrite-normalized abundance patterns. The major question to be addressed by any petrogenetic model for Apollo 15 mare basalts is how to form mare basalt suites with distinctly different major element characteristics but nearly identical trace element compositions. The similarity in trace element concentrations imply compositionally similar source regions and similar percent melting, but these conclusions are not easily reconciled with the observed differences in
Thermal Modeling and Simulation of Electron Beam Melting for Rapid Prototyping on Ti6Al4V Alloys
Neira Arce, Alderson
To be a viable solution for contemporary engineering challenges, the use of titanium alloys in a wider range of applications requires the development of new techniques and processes that are able to decrease production cost and delivery times. As a result, the use of material consolidation in a near-net-shape fashion, using dynamic techniques like additive manufacturing by electron beam selective melting EBSM represents a promising method for part manufacturing. However, a new product material development can be cost prohibitive, requiring the use of computer modeling and simulation as a way to decrease turnaround time. To ensure a proper representation of the EBSM process, a thermophysical material characterization and comparison was first performed on two Ti6Al4V powder feedstock materials prepared by plasma (PREP) and gas atomized (GA) processes. This evaluation comprises an evaluation on particle size distribution, density and powder surface area, collectively with the temperature dependence on properties such as heat capacity, thermal diffusivity, thermal conductivity and surface emissivity. Multiple techniques were employed in this evaluation, including high temperature differential scanning calorimetry (HT-DSC), laser flash analysis (LFA), infrared remote temperature analysis (IR-Thermography), laser diffraction, liquid and gas pycnometry using mercury and krypton adsorption respectively. This study was followed by the review of complementary strategies to simulate the temperature evolution during the EBSM process, using a finite element analysis package called COMSOL Multiphysics. Two alternatives dedicated to representing a moving heat source (electron beam) and the powder bed were developed using a step-by-step approximation initiative. The first method consisted of the depiction of a powder bed discretized on an array of domains, each one representing a static melt pool, where the moving heat source was illustrated by a series of time dependant selective
Directory of Open Access Journals (Sweden)
Andrea Chester
2013-08-01
Full Text Available Peer mentoring, presented as an inclusive teaching approach, embedded in the curriculum, has been successfully implemented to support first year student learning. Developing sustainable and scalable models for large first year cohorts, however, provides a challenge. The Transition in, Transition out model is a sustainable peer mentoring model supporting the transition of both first and final year students. The model has been implemented in two Australian psychology programs, one face-to-face and one delivered online. The focus in this Practice Report will be on the outcome data for on-campus first year student at one university. Participants were 231 first year students (166 females and 65 males. Results suggest positive changes in academic performance and learning approaches as well as positive endorsement of the model.
Model-dependence of the CO2 threshold for melting the hard Snowball Earth
Directory of Open Access Journals (Sweden)
W. R. Peltier
2011-01-01
Full Text Available One of the critical issues of the Snowball Earth hypothesis is the CO2 threshold for triggering the deglaciation. Using Community Atmospheric Model version 3.0 (CAM3, we study the problem for the CO2 threshold. Our simulations show large differences from previous results (e.g. Pierrehumbert, 2004, 2005; Le Hir et al., 2007. At 0.2 bars of CO2, the January maximum near-surface temperature is about 268 K, about 13 K higher than that in Pierrehumbert (2004, 2005, but lower than the value of 270 K for 0.1 bar of CO2 in Le Hir et al. (2007. It is found that the difference of simulation results is mainly due to model sensitivity of greenhouse effect and longwave cloud forcing to increasing CO2. At 0.2 bars of CO2, CAM3 yields 117 Wm−2 of clear-sky greenhouse effect and 32 Wm−2 of longwave cloud forcing, versus only about 77 Wm−2 and 10.5 Wm−2 in Pierrehumbert (2004, 2005, respectively. CAM3 has comparable clear-sky greenhouse effect to that in Le Hir et al. (2007, but lower longwave cloud forcing. CAM3 also produces much stronger Hadley cells than that in Pierrehumbert (2005. Effects of pressure broadening and collision-induced absorption are also studied using a radiative-convective model and CAM3. Both effects substantially increase surface temperature and thus lower the CO2 threshold. The radiative-convective model yields a CO2 threshold of about 0.21 bars with surface albedo of 0.663. Without considering the effects of pressure broadening and collision-induced absorption, CAM3 yields an approximate CO2 threshold of about 1.0 bar for surface albedo of about 0.6. However, the threshold is lowered to 0.38 bars as both effects are considered.
Czech Academy of Sciences Publication Activity Database
Hasalová, P.; Schulmann, K.; Lexa, O.; Štípská, P.; Hrouda, F.; Ulrich, Stanislav; Haloda, J.; Týcová, P.
2008-01-01
Roč. 26, č. 1 (2008), s. 29-53 ISSN 0263-4929 Grant - others:GA AV ČR(CZ) IAA3111401; GA ČR(CZ) GA205/04/2065 Institutional research plan: CEZ:AV0Z30120515 Keywords : crystal size distribution * melt infiltration * melt topology * migmatites * quantitative textural analysis Subject RIV: DB - Geology ; Mineralogy Impact factor: 3.340, year: 2008
Position-sensitive transition edge sensor modeling and results
Energy Technology Data Exchange (ETDEWEB)
Hammock, Christina E-mail: chammock@milkyway.gsfc.nasa.gov; Figueroa-Feliciano, Enectali; Apodaca, Emmanuel; Bandler, Simon; Boyce, Kevin; Chervenak, Jay; Finkbeiner, Fred; Kelley, Richard; Lindeman, Mark; Porter, Scott; Saab, Tarek; Stahle, Caroline
2004-03-11
We report the latest design and experimental results for a Position-Sensitive Transition-Edge Sensor (PoST). The PoST is motivated by the desire to achieve a larger field-of-view without increasing the number of readout channels. A PoST consists of a one-dimensional array of X-ray absorbers connected on each end to a Transition Edge Sensor (TES). Position differentiation is achieved through a comparison of pulses between the two TESs and X-ray energy is inferred from a sum of the two signals. Optimizing such a device involves studying the available parameter space which includes device properties such as heat capacity and thermal conductivity as well as TES read-out circuitry parameters. We present results for different regimes of operation and the effects on energy resolution, throughput, and position differentiation. Results and implications from a non-linear model developed to study the saturation effects unique to PoSTs are also presented.
Senese, Antonella; Maugeri, Maurizio; Vuillermoz, Elisa; Smiraglia, Claudio; Diolaiuti, Guglielmina
2014-05-01
Glacier melt occurs whenever the surface temperature is null (273.15 K) and the net energy budget is positive. These conditions can be assessed by analyzing meteorological and energy data acquired by a supraglacial Automatic Weather Station (AWS). In the case this latter is not present at the glacier surface the assessment of actual melting conditions and the evaluation of melt amount is difficult and degree-day (also named T-index) models are applied. These approaches require the choice of a correct temperature threshold. In fact, melt does not necessarily occur at daily air temperatures higher than 273.15 K, since it is determined by the energy budget which in turn is only indirectly affected by air temperature. This is the case of the late spring period when ablation processes start at the glacier surface thus progressively reducing snow thickness. In this study, to detect the most indicative air temperature threshold witnessing melt conditions in the April-June period, we analyzed air temperature data recorded from 2006 to 2012 by a supraglacial AWS (at 2631 m a.s.l.) on the ablation tongue of the Forni Glacier (Italy), and by a weather station located nearby the studied glacier (at Bormio, 1225 m a.s.l.). Moreover we evaluated the glacier energy budget (which gives the actual melt, Senese et al., 2012) and the snow water equivalent values during this time-frame. Then the ablation amount was estimated both from the surface energy balance (MEB from supraglacial AWS data) and from degree-day method (MT-INDEX, in this latter case applying the mean tropospheric lapse rate to temperature data acquired at Bormio changing the air temperature threshold) and the results were compared. We found that the mean tropospheric lapse rate permits a good and reliable reconstruction of daily glacier air temperature conditions and the major uncertainty in the computation of snow melt from degree-day models is driven by the choice of an appropriate air temperature threshold. Then
Langtry, R. B.; Menter, F. R.; Likki, S. R.; Suzen, Y. B.; Huang, P. G.; Volker, S.
2006-01-01
A new correlation-based transition model has been developed, which is built strictly on local variables. As a result, the transition model is compatible with modern computational fluid dynamics (CFD) methods using unstructured grids and massive parallel execution. The model is based on two transport equations, one for the intermittency and one for the transition onset criteria in terms of momentum thickness Reynolds number. The proposed transport equations do not attempt to model the physics of the transition process (unlike, e.g., turbulence models), but form a framework for the implementation of correlation-based models into general-purpose CFD methods.
Elastic Model Transitions Using Quadratic Inequality Constrained Least Squares
Orr, Jeb S.
2012-01-01
A technique is presented for initializing multiple discrete finite element model (FEM) mode sets for certain types of flight dynamics formulations that rely on superposition of orthogonal modes for modeling the elastic response. Such approaches are commonly used for modeling launch vehicle dynamics, and challenges arise due to the rapidly time-varying nature of the rigid-body and elastic characteristics. By way of an energy argument, a quadratic inequality constrained least squares (LSQI) algorithm is employed to e ect a smooth transition from one set of FEM eigenvectors to another with no requirement that the models be of similar dimension or that the eigenvectors be correlated in any particular way. The physically unrealistic and controversial method of eigenvector interpolation is completely avoided, and the discrete solution approximates that of the continuously varying system. The real-time computational burden is shown to be negligible due to convenient features of the solution method. Simulation results are presented, and applications to staging and other discontinuous mass changes are discussed
Senese, A.; Maugeri, M.; Vuillermoz, E.; Smiraglia, C.; Diolaiuti, G.
2014-10-01
Glacier melt conditions (i.e., null surface temperature and positive energy budget) can be assessed by analyzing data acquired by a supraglacial automatic weather station (AWS), such as the station installed on the surface of Forni Glacier (Italian Alps). When an AWS is not present, the assessment of actual melt conditions and the evaluation of the melt amount is more difficult and simple methods based on T-index (or degree days) models are generally applied. These models require the choice of a correct temperature threshold. In fact, melt does not necessarily occur at daily air temperatures higher than 0 °C. In this paper, we applied both energy budget and T-index approaches with the aim of solving this issue. We start by distinguishing between the occurrence of snowmelt and the reduction in snow depth due to actual ablation (from snow depth data recorded by a sonic ranger). Then we find the daily average temperature thresholds (by analyzing temperature data acquired by an AWS on Forni Glacier) which, on the one hand, best capture the occurrence of significant snowmelt conditions and, on the other, make it possible, using the T-index, to quantify the actual snow ablation amount. Finally we investigated the applicability of the mean tropospheric lapse rate to reproduce air temperature conditions at the glacier surface starting from data acquired by weather stations located outside the glacier area. We found that the mean tropospheric lapse rate allows for a good and reliable reconstruction of glacier air temperatures and that the choice of an appropriate temperature threshold in T-index models is a very important issue. From our study, the application of the +0.5 °C temperature threshold allows for a consistent quantification of snow ablation while, instead, for detecting the beginning of the snow melting processes a suitable threshold has proven to be at least -4.6 °C.
Thermodynamically consistent mesoscopic model of the ferro/paramagnetic transition
Czech Academy of Sciences Publication Activity Database
Benešová, Barbora; Kružík, Martin; Roubíček, Tomáš
2013-01-01
Roč. 64, Č. 1 (2013), s. 1-28 ISSN 0044-2275 R&D Projects: GA AV ČR IAA100750802; GA ČR GA106/09/1573; GA ČR GAP201/10/0357 Grant - others:GA ČR(CZ) GA106/08/1397; GA MŠk(CZ) LC06052 Program:GA; LC Institutional support: RVO:67985556 Keywords : ferro-para-magnetism * evolution * thermodynamics Subject RIV: BA - General Mathematics; BA - General Mathematics (UT-L) Impact factor: 1.214, year: 2013 http://library.utia.cas.cz/separaty/2012/MTR/kruzik-thermodynamically consistent mesoscopic model of the ferro-paramagnetic transition.pdf
Band to Mott transition in the infinite dimensional Holstein model
Hague, J P
2001-01-01
down at intermediate couplings in the limit of low phonon frequency where it is supposed to be most applicable. By examining the effective hopping and renormalized phonon frequency, I suggest an intuitive explanation for the breakdown of Migdal-Eliashberg theory. For completeness, a description of the breakdown of Migdal's theorem in the limit of high phonon frequency is considered via the Lang-Firsov canonical transformation. The Holstein model can be seen as providing an interpolation scheme between Hubbard-like and Falicov-Kimball like behaviour and it may therefore help elucidate the nature of the transition between band and Mott states. I describe a number of approximations to the self-energy. By comparing these with results from the exact solution in various limits, I find that a second order iterated perturbation scheme may be capable of describing the intermediate behaviour. Application of this method reveals a strongly renormalized hybrid behaviour between band and miniature-Mott states, with unusual...
Transport modeling of L/H transition in Tokamaks
International Nuclear Information System (INIS)
Fuji, Y.; Fukuyama, A.; Itoh, K.; Itoh, S.I.
1995-01-01
In order to study the particle transport and the mechanism of the L/H transition in tokamaks, a one-dimensional transport code which describes the toroidal and poloidal plasma rotation as well as the radial electric field has been developed. The neoclassical transport, turbulent transport and ion orbit loss are included. Using a turbulent transport model based on the current diffusive high-n ballooning mode and a fixed temperature profile, the density profile in a steady state and the dependence on the edge temperature are studied. With high edge temperature, the density gradient near the edge becomes steep and a H-mode like density profile is obtained. The preliminary calculation including heat transport is also presented. 10 refs., 3 figs
Phases and phase transitions in the algebraic microscopic shell model
Directory of Open Access Journals (Sweden)
Georgieva A. I.
2016-01-01
Full Text Available We explore the dynamical symmetries of the shell model number conserving algebra, which define three types of pairing and quadrupole phases, with the aim to obtain the prevailing phase or phase transition for the real nuclear systems in a single shell. This is achieved by establishing a correspondence between each of the pairing bases with the Elliott’s SU(3 basis that describes collective rotation of nuclear systems. This allows for a complete classification of the basis states of different number of particles in all the limiting cases. The probability distribution of the SU(3 basis states within theirs corresponding pairing states is also obtained. The relative strengths of dynamically symmetric quadrupole-quadrupole interaction in respect to the isoscalar, isovector and total pairing interactions define a control parameter, which estimates the importance of each term of the Hamiltonian in the correct reproduction of the experimental data for the considered nuclei.
Technology Transition a Model for Infusion and Commercialization
McMillan, Vernotto C.
2006-01-01
The National Aeronautics and Space Administration has as part of its charter the mission of transferring technologies developed for the space program into the private sector for the purpose of affording back to the American people the economical and improved quality of life benefits associated with the technologies developed. In recent years considerable effort has been made to use this program for not only transitioning technologies out of the NASA Mission Directorate Programs, but also to transfer technologies into the Mission Directorate Programs and leverage the impact of government and private sector innovation. The objective of this paper is to outline an approach and the creation of a model that brings together industry, government, and commercialization strategies. When these elements are integrated, the probability of successful technology development, technology infusion into the Mission Programs, and commercialization into the private sector is increased. This model primarily addresses technology readiness levels between TRL 3 and TRL 6. This is typically a gap area known as the valley of death. This gap area is too low for commercial entities to invest heavily and not developed enough for major programs to actively pursue. This model has shown promise for increasing the probably of TRL advancement to an acceptable level for NASA programs and/or commercial entities to afford large investments toward either commercialization or infusion.
Halbe, Johannes; Reusser, Dominik E.; Holtz, Gerog; Stosius, Annette; Kwakkel, Jan; Haasnoot, Marjolijn; Avenhaus, Wiebke
2013-04-01
The delineation of transition pathways towards sustainability and the implementation of associated measures are challenged by uncertainty, structural barriers, and conflicts among affected stakeholders. Experiences from other research domains suggest that the effective application of models to tackle these challenges require the explicit consideration of modeling purposes and roles. We present a classification of modeling roles for the analysis and governance of transitions. Models can support understanding of transitions processes, detect barriers and drivers of change, support the exploration of pathways towards sustainability, and help to actively engage relevant stakeholder groups. For each application area, examples are provided from the transition community and related research fields like environmental modeling and integrated assessment.
International Nuclear Information System (INIS)
Foit, J.J.; Adroguer, B.; Cenerino, G.; Stiefel, S.
1995-02-01
The WECHSL-Mod3 code is a mechanistic computer code developed for the analysis of the thermal and chemical interaction of initially molten reactor materials with concrete in a two-dimensional as well as in a one-dimensional, axisymmetrical concrete cavity. The code performs calculations from the time of initial contact of a hot molten pool over start of solidification processes until long term basemat erosion over several days with the possibility of basemat penetration. It is assumed that an underlying metallic layer exists covered by an oxidic layer or that only one oxidic layer is present which can contain a homogeneously dispersed metallic phase. Heat generation in the melt is by decay heat and chemical reactions from metal oxidation. Energy is lost to the melting concrete and to the upper containment by radiation or evaporation of sumpwater possibly flooding the surface of the melt. Thermodynamic and transport properties as well as criteria for heat transfer and solidification processes are internally calculated for each time step. Heat transfer is modelled taking into account the high gas flux from the decomposing concrete and the heat conduction in the crusts possibly forming in the long term at the melt/concrete interface. The CALTHER code (developed at CEA, France) which models the radiative heat transfer from the upper surface of the corium melt to the surrounding cavity is implemented in the present WECHSL version. The WECHSL code in its present version was validated by the BETA, ACE and SURC experiments. The test samples include a BETA and the SURC2 post test calculations and a WECHSL application to a reactor accident. (orig.) [de
Directory of Open Access Journals (Sweden)
M. Blaschek
2013-07-01
Full Text Available The relatively warm early Holocene climate in the Nordic Seas, known as the Holocene thermal maximum (HTM, is often associated with an orbitally forced summer insolation maximum at 10 ka BP. The spatial and temporal response recorded in proxy data in the North Atlantic and the Nordic Seas reveals a complex interaction of mechanisms active in the HTM. Previous studies have investigated the impact of the Laurentide Ice Sheet (LIS, as a remnant from the previous glacial period, altering climate conditions with a continuous supply of melt water to the Labrador Sea and adjacent seas and with a downwind cooling effect from the remnant LIS. In our present work we extend this approach by investigating the impact of the Greenland Ice Sheet (GIS on the early Holocene climate and the HTM. Reconstructions suggest melt rates of 13 mSv for 9 ka BP, which result in our model in an ocean surface cooling of up to 2 K near Greenland. Reconstructed summer SST gradients agree best with our simulation including GIS melt, confirming that the impact of the early Holocene GIS is crucial for understanding the HTM characteristics in the Nordic Seas area. This implies that modern and near-future GIS melt can be expected to play an active role in the climate system in the centuries to come.
Bessat, A.; Pilet, S.; Duretz, T.; Schmalholz, S. M.
2017-12-01
Petit-spot volcanoes were found fifteen years ago by Japanese researchers at the top of the subducting plate in Japan (Hirano 2006). This discovery is of great significance as it highlights the importance of tectonic processes for the initiation of intraplate volcanism. The location of these small lava flows is unusual and seems to be related to the plate flexure, which may facilitate the extraction of low degree melts from the base of the lithosphere, a hypothesis previously suggested to explain changes in electric and seismic properties at 70-90 km depth, i.e. within the low velocity zone (LVS) (Sifré 2014). A critical question is related to the process associated with the extraction of this low degree melts from the LVZ. First models suggested that extension associated to plate bending allows large cracks to propagate across the lithosphere and could promote the extraction of low degree melts at the base of the lithosphere (Hirano 2006 & Yamamoto 2014). However, the study of petit-spot mantle xenoliths from Japan (Pilet 2016) has demonstrated that low degree melts are not directly extracted to the surface but percolate, interact and metasomatize the oceanic lithosphere. In order to understand the melt extraction process in the region of plate bending, we performed 2D thermo-mechanical simulations of Japanese-type subduction. The numerical model considers viscoelastoplastic deformation. This allows the quantification of state of the stress, strain rates, and viscosities which will control the percolation of melt initially stocked at the base of the lithosphere. Initial results show that plate flexure changes the distribution of the deformation mechanism in the flexure zone, between 40 km to 80 km depth. A change of the dominant deformation mechanism from diffusion creep to dislocation creep and from there to Peierls creep was observed about 200 to 300 km from the trench. These changes are linked to the augmentation of the stresses in the flexure zone. At the
Rapid Mantle-Crust Transit Times Derived From Crystal Zonation Modeling
Ruprecht, P.; Plank, T.
2012-12-01
The timescales of magma transit through the entire crustal column in mature volcanic plumbing systems have been elusive, as both geophysical and geochemical techniques are most sensitive to upper crustal processes. Geophysical studies of the lower crust are often hampered by the small signal-to-noise ratio and the absence of intrinsically large earthquakes as a result of limited stress build-up. However, new approaches in seismic studies (Shelly and Hill, 2011; Tarasewicz et al., 2012) use waveform cross correlation techniques to augment existing earthquake catalogs and document hypocenter migration associated with fluid movement within the entire crust and even within the uppermost mantle. This technique is limited to (1) well-monitored volcanic systems and (2) transient magma transport that may or may not be associated with current volcanic activity. Complementary to these seismic approaches, we have developed a geochemical speedometer on the basis of trace element diffusion modeling (primarily Ni) in primitive olivine "phenocrysts" that integrates over the entire crustal ascent path and can be used to extract ascent rates from both current and older eruptions. Underlying the use of the geochemical speedometer is the assumption that primitive (> Fo88) olivines crystallize close to the Moho and then are transported without long-term (> one year) storage in the crust. We present thermal dike models showing that the conditions in the crust are unfavorable for the long-term preservation of primitive olivine crystals as cooling, differentiation, and diffusive re-equilibration inevitably lead to lower Fo olivines. Furthermore, distinct trace element signatures (e.g., Ni, Cr, Ca) in individual phenocrysts require the presence of compositionally distinct mantle-derived melts that most likely pool at the rheologic boundary of the Moho. Crystallizing olivine then captures these distinct melts during a first episode of cooling. Their magmatic origin is supported by high Ca
Modelling transition states of a small once-through boiler
Energy Technology Data Exchange (ETDEWEB)
Talonpoika, T. [Lappeenranta Univ. of Technology (Finland). Dept. of Energy Technology
1997-12-31
This article presents a model for the unsteady dynamic behaviour of a once-through counter flow boiler that uses an organic working fluid. The boiler is a compact waste-heat boiler without a furnace and it has a preheater, a vaporiser and a superheater. The relative lengths of the boiler parts vary with the operating conditions since they are all parts of a single tube. The boiler model is presented using a selected example case that uses toluene as the process fluid and flue gas from natural gas combustion as the heat source. The dynamic behaviour of the boiler means transition from the steady initial state towards another steady state that corresponds to the changed process conditions. The solution method chosen is to find such a pressure of the process fluid that the mass of the process fluid in the boiler equals the mass calculated using the mass flows into and out of the boiler during a time step, using the finite difference method. A special method of fast calculation of the thermal properties is used, because most of the calculation time is spent in calculating the fluid properties. The boiler is divided into elements. The values of the thermodynamic properties and mass flows are calculated in the nodes that connect the elements. Dynamic behaviour is limited to the process fluid and tube wall, and the heat source is regarded as to be steady. The elements that connect the preheater to the vaporiser and the vaporiser to the superheater are treated in a special way that takes into account a flexible change from one part to the other. The initial state of the boiler is received from a steady process model that is not a part of the boiler model. The known boundary values that may vary during the dynamic calculation were the inlet temperature and mass flow rates of both the heat source fluid and the process fluid. The dynamic boiler model is analysed for linear and step charges of the entering fluid temperatures and flow rates. The heat source side tests show that
Optimisation of timetable-based, stochastic transit assignment models based on MSA
DEFF Research Database (Denmark)
Nielsen, Otto Anker; Frederiksen, Rasmus Dyhr
2006-01-01
(CRM), such a large-scale transit assignment model was developed and estimated. The Stochastic User Equilibrium problem was solved by the Method of Successive Averages (MSA). However, the model suffered from very large calculation times. The paper focuses on how to optimise transit assignment models...
Estimation and asymptotic theory for transition probabilities in markov renewal multi-state models
Spitoni, Cristian|info:eu-repo/dai/nl/304625957; Verduijn, Marion; Putter, Hein
2014-01-01
In this paper we discuss estimation of transition probabilities for semi-Markov multi-state models. Non-parametric and semi-parametric estimators of the transition probabilities for a large class of models (forward going models) are proposed. Large sample theory is derived using the functional delta
Lindsay, Sally; Proulx, Meghann; Maxwell, Joanne; Hamdani, Yani; Bayley, Mark; Macarthur, Colin; Colantonio, Angela
2016-02-01
To explore gender and sex differences in experiences of transitioning to adult health care among young adults with acquired brain injury (ABI) who take part in a coordinated model of transitional care. Descriptive design using in-depth semistructured qualitative interviews. Interviews over the phone and in person. Participants (N=18) included 10 young adults with a diagnosis of ABI (4 women, 6 men; age range, 19-21y) and 9 parents (8 women, 1 man) from the Greater Toronto Area, Ontario, Canada. Not applicable. Semistructured interviews with participants. Our findings highlight several commonalities and differences relative to sex and gender among young adults with ABI who are transitioning from pediatric to adult care. Both young adult men and women experienced a similar transition process and similar organization, continuity, and availability of care. Sex differences were found in relational factors (eg, communication, family involvement, social support). Young adult men, and parents of the men, differed in their transition regarding relational factors (eg, communication, family involvement). Our findings show that young adult men and women with ABI who have taken part in a transition preparation program experience similarities in organization, continuity, and availability of care, but they experience differences in relational factors (eg, communication, family involvement). Copyright © 2016 American Congress of Rehabilitation Medicine. Published by Elsevier Inc. All rights reserved.
DEFF Research Database (Denmark)
Azarang, Leyla; Scheike, Thomas; de Uña-Álvarez, Jacobo
2017-01-01
In this work, we present direct regression analysis for the transition probabilities in the possibly non-Markov progressive illness–death model. The method is based on binomial regression, where the response is the indicator of the occupancy for the given state along time. Randomly weighted score...
DEFF Research Database (Denmark)
Silvennoinen, Annastiina; Teräsvirta, Timo
another variable according to which the correlations change smoothly between states of constant correlations. A Lagrange multiplier test is derived to test the constancy of correlations against the DSTCC-GARCH model, and another one to test for another transition in the STCC-GARCH framework. In addition...
Glass Transition Temperature- and Specific Volume- Composition Models for Tellurite Glasses
Energy Technology Data Exchange (ETDEWEB)
Riley, Brian J. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Vienna, John D. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States)
2017-09-01
This report provides models for predicting composition-properties for tellurite glasses, namely specific gravity and glass transition temperature. Included are the partial specific coefficients for each model, the component validity ranges, and model fit parameters.
Pediatric to adult transition: a quality improvement model for primary care.
McManus, Margaret; White, Patience; Barbour, April; Downing, Billie; Hawkins, Kirsten; Quion, Nathalie; Tuchman, Lisa; Cooley, W Carl; McAllister, Jeanne W
2015-01-01
To examine the relationship between quality improvement activities with pediatric and adult primary care practices and improvements in transition from pediatric to adult care. This was a time-series comparative study of changes in pediatric and adult practices involving five large pediatric and adult academic health centers in the District of Columbia. Using the Health Care Transition Index (pediatric and adult versions), we examined improvements in specific indicators of transition performance, including development of an office transition policy, provider knowledge and skills related to transition, identification of transitioning youth, transition preparation of youth, transition planning, and transfer of care. Improvements took place in all six transition quality indicators in the pediatric and adult practices that participated in a 2-year learning collaborative to implement the "Six Core Elements of Health Care Transition," a quality improvement intervention modeled after the American Academy of Pediatrics/American Academy of Family Physicians/American College of Physicians Clinical Report on Transition. All sites established a practice-wide policy on transition and created an organized clinical process for tracking transition preparation. The pediatric sites conducted transition readiness assessments with 88% of eligible youth and prepared transition plans for 29% of this group. The adult sites conducted transition readiness assessments with 73% of eligible young adults and developed plans for 33%. A total of 50 were transferred in a systematic way to adult primary care practices. Quality improvement using the Six Core Elements of Health Care Transition resulted in the development of a systematic clinical transition process in pediatric and adult academic primary care practices. Copyright © 2015 Society for Adolescent Health and Medicine. Published by Elsevier Inc. All rights reserved.
The Ballet Dancing Profession: A Career Transition Model
Roncaglia, Irina
2008-01-01
What type of emotional transition is experienced by professional dancers who face the end of their career? What does this journey imply? This article discusses the transition experiences of two case studies out of a total sample of fourteen (N = 14) international professional ballet dancers who left their careers between the ages of 21 and 49…
A rigidity transition and glassy dynamics in a model for confluent 3D tissues
Merkel, Matthias; Manning, M. Lisa
The origin of rigidity in disordered materials is an outstanding open problem in statistical physics. Recently, a new type of rigidity transition was discovered in a family of models for 2D biological tissues, but the mechanisms responsible for rigidity remain unclear. This is not just a statistical physics problem, but also relevant for embryonic development, cancer growth, and wound healing. To gain insight into this rigidity transition and make new predictions about biological bulk tissues, we have developed a fully 3D self-propelled Voronoi (SPV) model. The model takes into account shape, elasticity, and self-propelled motion of the individual cells. We find that in the absence of self-propulsion, this model exhibits a rigidity transition that is controlled by a dimensionless model parameter describing the preferred cell shape, with an accompanying structural order parameter. In the presence of self-propulsion, the rigidity transition appears as a glass-like transition featuring caging and aging effects. Given the similarities between this transition and jamming in particulate solids, it is natural to ask if the two transitions are related. By comparing statistics of Voronoi geometries, we show the transitions are surprisingly close but demonstrably distinct. Furthermore, an index theorem used to identify topologically protected mechanical modes in jammed systems can be extended to these vertex-type models. In our model, residual stresses govern the transition and enter the index theorem in a different way compared to jammed particles, suggesting the origin of rigidity may be different between the two.
The democracy ochlocracy dictatorship transition in the Sznajd model and in the Ising model
Schneider, Johannes J.; Hirtreiter, Christian
2005-08-01
Since its introduction in 2000, the Sznajd model has been assumed to simulate a democratic community with two parties. The main flaw in this model is that a Sznajd system freezes in the long term in a non-democratic state, which can be either a dictatorship or a stalemate configuration. Here we show that the Sznajd model has better to be considered as a transition model, transferring a democratic system already at the beginning of a simulation via an ochlocratic scenario, i.e., a regime in which several mobs rule, to a dictatorship, thus reproducing the corresponding Aristotelian theory.
Electrical resistivity discontinuity of iron along the melting curve
Wagle, Fabian; Steinle-Neumann, Gerd
2018-04-01
Discontinuous changes of electrical resistivity ρel (increase), density ϱ and isothermal compressibility βT (decrease) occur across the melting temperature of metals and can be directly related by Ziman's theory in the long-wavelength approximation. By evaluating experimental data at ambient pressure, we show that Ziman's approximation holds for iron and other simple and transition metals. Using a thermodynamic model to determine βT for γ-, ɛ- and liquid Fe and a previously published model for ρel of liquid Fe, we apply Ziman's approximation to calculate ρel of solid Fe along the melting curve. For pure Fe, we find the discontinuity in ρel to decrease with pressure and to be negligibly small at inner core boundary conditions. However, if we account for light element enrichment in the liquid outer core, the electrical resistivity decrease across the inner core boundary is predicted to be as large as 36 per cent.
Energy Demand Modeling Methodology of Key State Transitions of Turning Processes
Directory of Open Access Journals (Sweden)
Shun Jia
2017-04-01
Full Text Available Energy demand modeling of machining processes is the foundation of energy optimization. Energy demand of machining state transition is integral to the energy requirements of the machining process. However, research focus on energy modeling of state transition is scarce. To fill this gap, an energy demand modeling methodology of key state transitions of the turning process is proposed. The establishment of an energy demand model of state transition could improve the accuracy of the energy model of the machining process, which also provides an accurate model and reliable data for energy optimization of the machining process. Finally, case studies were conducted on a CK6153i CNC lathe, the results demonstrating that predictive accuracy with the proposed method is generally above 90% for the state transition cases.
Franz, Silvio; Gradenigo, Giacomo; Spigler, Stefano
2016-03-01
We study how the thermodynamic properties of the triangular plaquette model (TPM) are influenced by the addition of extra interactions. The thermodynamics of the original TPM is trivial, while its dynamics is glassy, as usual in kinetically constrained models. As soon as we generalize the model to include additional interactions, a thermodynamic phase transition appears in the system. The additional interactions we consider are either short ranged, forming a regular lattice in the plane, or long ranged of the small-world kind. In the case of long-range interactions we call the new model the random-diluted TPM. We provide arguments that the model so modified should undergo a thermodynamic phase transition, and that in the long-range case this is a glass transition of the "random first-order" kind. Finally, we give support to our conjectures studying the finite-temperature phase diagram of the random-diluted TPM in the Bethe approximation. This corresponds to the exact calculation on the random regular graph, where free energy and configurational entropy can be computed by means of the cavity equations.
Scaleable Clean Aluminum Melting Systems
Energy Technology Data Exchange (ETDEWEB)
Han, Q.; Das, S.K. (Secat, Inc.)
2008-02-15
The project entitled 'Scaleable Clean Aluminum Melting Systems' was a Cooperative Research and Development Agreements (CRADAs) between Oak Ridge National Laboratory (ORNL) and Secat Inc. The three-year project was initially funded for the first year and was then canceled due to funding cuts at the DOE headquarters. The limited funds allowed the research team to visit industrial sites and investigate the status of using immersion heaters for aluminum melting applications. Primary concepts were proposed on the design of furnaces using immersion heaters for melting. The proposed project can continue if the funding agency resumes the funds to this research. The objective of this project was to develop and demonstrate integrated, retrofitable technologies for clean melting systems for aluminum in both the Metal Casting and integrated aluminum processing industries. The scope focused on immersion heating coupled with metal circulation systems that provide significant opportunity for energy savings as well as reduction of melt loss in the form of dross. The project aimed at the development and integration of technologies that would enable significant reduction in the energy consumption and environmental impacts of melting aluminum through substitution of immersion heating for the conventional radiant burner methods used in reverberatory furnaces. Specifically, the program would couple heater improvements with furnace modeling that would enable cost-effective retrofits to a range of existing furnace sizes, reducing the economic barrier to application.
DEFF Research Database (Denmark)
Ford, E.B.; Ragozzine, D.; Holman, M.J.
2012-01-01
Transit timing variations provide a powerful tool for confirming and characterizing transiting planets, as well as detecting non-transiting planets. We report the results of an updated transit timing variation (TTV) analysis for 1481 planet candidates based on transit times measured during...... find that the occurrence rate of planet candidates that show TTVs is significantly increased (~68%) for planet candidates transiting stars with multiple transiting planet candidates when compared to planet candidates transiting stars with a single transiting planet candidate....
Predicting landscape vegetation dynamics using state-and-transition simulation models
Colin J. Daniel; Leonardo. Frid
2012-01-01
This paper outlines how state-and-transition simulation models (STSMs) can be used to project changes in vegetation over time across a landscape. STSMs are stochastic, empirical simulation models that use an adapted Markov chain approach to predict how vegetation will transition between states over time, typically in response to interactions between succession,...
Exactly solvable model of phase transition between hadron and quark-gluon-matter
International Nuclear Information System (INIS)
Gorenstein, M.I.; Petrov, V.K.; Shelest, V.P.; Zinovjev, G.M.
1982-01-01
An exactly solvable model of phase transition between hadron and quark-gluon matter is proposed. The hadron phase of this model is considered as a gas of bags filled by point massless constituents. The mass and volume spectrum of the bag is found. The thermodynamical characteristics of a bag gas in the neighbourhood of a phase transition point are ascertained in analytical form
Modeling taxi demand with GPS data from taxis and transit.
2014-07-01
Identifying factors that influence taxi demand is very important for understanding where and when people use taxis and how taxi demand relates to the availability and quality of transit service. This study used a large set of global positioning syste...
Dong, J.; Li, J.; Zhu, F.; Li, Z.; Farawi, R.
2017-12-01
The whereabouts of subducted carbonates place a major constraint on the Earth's deep carbon cycle, but the fraction of carbon retained in the slab and transported into the deep mantle, compared to that released from the slab and recycled to the surface, is still under debate. Knowledge of the stability of carbonated mantle rocks is pivotal for assessing the ability of slabs to carry carbonates into the deep mantle. Determination and systematic comparison of the melting curves of alkali and alkaline earth carbonates at high pressure can help construct thermodynamic models to predict the melting behavior of complex carbonated mantle rocks. Among alkaline earth carbonates, the melting behavior of barium carbonate (BaCO3) has not been adequately understood. The reported melting point of BaCO3at 1 bar differ by nearly 800 °C and constraints on the melting curve of BaCO3 at high pressure are not available. In this study, the melting temperatures of BaCO3 were determined up to 11 GPa from in situ ionic conductivity measurements using the multi-anvil apparatus at the University of Michigan. The solid-liquid boundary at high pressure was detected on the basis of a steep rise in conductivity through the sample upon melting. The melting point of BaCO3 was found to drop from 1797 °C at 3.3 GPa to 1600 °C at 5.5 GPa and then rise with pressure to 2180 °C at 11 GPa. The observed melting depression point at 5.5 GPa corresponds to the phase transition of BaCO3 from the aragonite structure (Pmcn) to post-aragonite structure (Pmmn) at 6.3 GPa, 877 °C and 8.0 GPa, 727 °C, determined from synchrotron X-ray diffraction measurements using laser-heated DAC experiments at the Advanced Photon Source, Argonne National Laboratory. These results are also compared with ex situ falling marker experiments, and the three methods together place tight constraints on the melting curve of BaCO3 and elucidates the effect of structural phase transitions on its melting behavior.
Matt, Felix; Burkhart, John F.
2017-04-01
Light absorbing impurities in snow and ice (LAISI) originating from atmospheric deposition enhance snow melt by increasing the absorption of short wave radiation. The consequences are a shortening of the snow cover duration due to increased snow melt and, with respect to hydrologic processes, a temporal shift in the discharge generation. However, the magnitude of these effects as simulated in numerical models have large uncertainties, originating mainly from uncertainties in the wet and dry deposition of light absorbing aerosols, limitations in the model representation of the snowpack, and the lack of observable variables required to estimate model parameters and evaluate the simulated variables connected with the representation of LAISI. This leads to high uncertainties in the additional energy absorbed by the snow due to the presence of LAISI, a key variable in understanding snowpack energy-balance dynamics. In this study, we assess the effect of LAISI on snow melt and discharge generation and the involved uncertainties in a high mountain catchment located in the western Himalayas by using a distributed hydrological catchment model with focus on the representation of the seasonal snow pack. The snow albedo is hereby calculated from a radiative transfer model for snow, taking the increased absorption of short wave radiation by LAISI into account. Meteorological forcing data is generated from an assimilation of observations and high resolution WRF simulations, and LAISI mixing ratios from deposition rates of Black Carbon simulated with the FLEXPART model. To asses the quality of our simulations and the related uncertainties, we compare the simulated additional energy absorbed by the snow due to the presence of LAISI to the MODIS Dust Radiative Forcing in Snow (MODDRFS) algorithm satellite product.
String-like cooperative motion in homogeneous melting.
Zhang, Hao; Khalkhali, Mohammad; Liu, Qingxia; Douglas, Jack F
2013-03-28
Despite the fundamental nature and practical importance of melting, there is still no generally accepted theory of this ubiquitous phenomenon. Even the earliest simulations of melting of hard discs by Alder and Wainwright indicated the active role of collective atomic motion in melting and here we utilize molecular dynamics simulation to determine whether these correlated motions are similar to those found in recent studies of glass-forming (GF) liquids and other condensed, strongly interacting, particle systems. We indeed find string-like collective atomic motion in our simulations of "superheated" Ni crystals, but other observations indicate significant differences from GF liquids. For example, we observe neither stretched exponential structural relaxation, nor any decoupling phenomenon, while we do find a boson peak, findings that have strong implications for understanding the physical origin of these universal properties of GF liquids. Our simulations also provide a novel view of "homogeneous" melting in which a small concentration of interstitial defects exerts a powerful effect on the crystal stability through their initiation and propagation of collective atomic motion. These relatively rare point defects are found to propagate down the strings like solitons, driving the collective motion. Crystal integrity remains preserved when the permutational atomic motions take the form of ring-like atomic exchanges, but a topological transition occurs at higher temperatures where the rings open to form linear chains similar in geometrical form and length distribution to the strings of GF liquids. The local symmetry breaking effect of the open strings apparently destabilizes the local lattice structure and precipitates crystal melting. The crystal defects are thus not static entities under dynamic conditions, such as elevated temperatures or material loading, but rather are active agents exhibiting a rich nonlinear dynamics that is not addressed in conventional "static
Stochastic resonance induced by novel random transitions of motion of FitzHugh-Nagumo neuron model
International Nuclear Information System (INIS)
Zhang Guangjun; Xu Jianxue
2005-01-01
In contrast to the previous studies which have dealt with stochastic resonance induced by random transitions of system motion between two coexisting limit cycle attractors in the FitzHugh-Nagumo (FHN) neuron model after Hopf bifurcation and which have dealt with the phenomenon of stochastic resonance induced by external noise when the model with periodic input has only one attractor before Hopf bifurcation, in this paper we have focused our attention on stochastic resonance (SR) induced by a novel transition behavior, the transitions of motion of the model among one attractor on the left side of bifurcation point and two attractors on the right side of bifurcation point under the perturbation of noise. The results of research show: since one bifurcation of transition from one to two limit cycle attractors and the other bifurcation of transition from two to one limit cycle attractors occur in turn besides Hopf bifurcation, the novel transitions of motion of the model occur when bifurcation parameter is perturbed by weak internal noise; the bifurcation point of the model may stochastically slightly shift to the left or right when FHN neuron model is perturbed by external Gaussian distributed white noise, and then the novel transitions of system motion also occur under the perturbation of external noise; the novel transitions could induce SR alone, and when the novel transitions of motion of the model and the traditional transitions between two coexisting limit cycle attractors after bifurcation occur in the same process the SR also may occur with complicated behaviors types; the mechanism of SR induced by external noise when FHN neuron model with periodic input has only one attractor before Hopf bifurcation is related to this kind of novel transition mentioned above
Hardening transition in a one-dimensional model for ferrogels.
Annunziata, Mario Alberto; Menzel, Andreas M; Löwen, Hartmut
2013-05-28
We introduce and investigate a coarse-grained model for quasi one-dimensional ferrogels. In our description the magnetic particles are represented by hard spheres with a magnetic dipole moment in their centers. Harmonic springs connecting these spheres mimic the presence of a cross-linked polymer matrix. A special emphasis is put on the coupling of the dipolar orientations to the elastic deformations of the matrix, where a memory effect of the orientations is included. Although the particles are displaced along one spatial direction only, the system already shows rich behavior: as a function of the magnetic dipole moment, we find a phase transition between "soft-elastic" states with finite interparticle separation and finite compressive elastic modulus on the one hand, and "hardened" states with touching particles and therefore diverging compressive elastic modulus on the other hand. Corresponding phase diagrams are derived neglecting thermal fluctuations of the magnetic particles. In addition, we consider a situation in which a spatially homogeneous magnetization is initially imprinted into the material. Depending on the strength of the magneto-mechanical coupling between the dipole orientations and the elastic deformations, the system then relaxes to a uniaxially ferromagnetic, an antiferromagnetic, or a spiral state of magnetization to minimize its energy. One purpose of our work is to provide a largely analytically solvable approach that can provide a benchmark to test future descriptions of higher complexity. From an applied point of view, our results could be exploited, for example, for the construction of novel damping devices of tunable shock absorbance.
Finland: a model of energy transition to be followed?
International Nuclear Information System (INIS)
Lorot, Pascal
2014-09-01
Published before the debate of the French Parliament on the law on energy transition, i.e. on a new energy model, or on the construction of a low carbon and less energy consuming society to comply with France's international commitments, this report first discusses the French situation, the evolution of its energy policy, the challenge of a search for a balance between a cheap electricity and energy independence, and the plurality of factors and objectives (economic, budgetary, environmental, industrial, societal, political and social) which are sometime contradictory. The second part presents and comments the case of Germany which seems to be a good example regarding energy policy, however it faces some difficulties and pitfalls: a quick evolution of the energy mix in favour of renewable energies, but an always higher cost supported almost only by individuals, a disturbed electricity market, an environmental impact due to the wider use of coal (less expensive than gas). The third part addresses the case of Finland which could be a more inspiring example: no decision to phase out nuclear, no decision of a quick and forced development of renewable energies, modification of the energy mix by the development of local forest resources, an electric system of good quality, a high energetic competitiveness. The report outlines the consistency of the Finnish policy: search for a balance between international commitments of reduction of greenhouse gas emissions, competitive tariffs, and strengthening of energetic independence. The associated choices are discussed, and it appears that the cost-efficiency criterion is prevailing
Melting of size-selected gallium clusters with 60-183 atoms.
Pyfer, Katheryne L; Kafader, Jared O; Yalamanchali, Anirudh; Jarrold, Martin F
2014-07-10
Heat capacities have been measured as a function of temperature for size-selected gallium cluster cations with between 60 and 183 atoms. Almost all clusters studied show a single peak in the heat capacity that is attributed to a melting transition. The peaks can be fit by a two-state model incorporating only fully solid-like and fully liquid-like species, and hence no partially melted intermediates. The exceptions are Ga90(+), which does not show a peak, and Ga80(+) and Ga81(+), which show two peaks. For the clusters with two peaks, the lower temperature peak is attributed to a structural transition. The melting temperatures for clusters with less than 50 atoms have previously been shown to be hundreds of degrees above the bulk melting point. For clusters with more than 60 atoms the melting temperatures decrease, approaching the bulk value (303 K) at around 95 atoms, and then show several small upward excursions with increasing cluster size. A plot of the latent heat against the entropy change for melting reveals two groups of clusters: the latent heats and entropy changes for clusters with less than 94 atoms are distinct from those for clusters with more than 93 atoms. This observation suggests that a significant change in the nature of the bonding or the structure of the clusters occurs at 93-94 atoms. Even though the melting temperatures are close to the bulk value for the larger clusters studied here, the latent heats and entropies of melting are still far from the bulk values.
Criales Escobar, Luis Ernesto
One of the most frequently evolving areas of research is the utilization of lasers for micro-manufacturing and additive manufacturing purposes. The use of laser beam as a tool for manufacturing arises from the need for flexible and rapid manufacturing at a low-to-mid cost. Laser micro-machining provides an advantage over mechanical micro-machining due to the faster production times of large batch sizes and the high costs associated with specific tools. Laser based additive manufacturing enables processing of powder metals for direct and rapid fabrication of products. Therefore, laser processing can be viewed as a fast, flexible, and cost-effective approach compared to traditional manufacturing processes. Two types of laser processing techniques are studied: laser ablation of polymers for micro-channel fabrication and selective laser melting of metal powders. Initially, a feasibility study for laser-based micro-channel fabrication of poly(dimethylsiloxane) (PDMS) via experimentation is presented. In particular, the effectiveness of utilizing a nanosecond-pulsed laser as the energy source for laser ablation is studied. The results are analyzed statistically and a relationship between process parameters and micro-channel dimensions is established. Additionally, a process model is introduced for predicting channel depth. Model outputs are compared and analyzed to experimental results. The second part of this research focuses on a physics-based FEM approach for predicting the temperature profile and melt pool geometry in selective laser melting (SLM) of metal powders. Temperature profiles are calculated for a moving laser heat source to understand the temperature rise due to heating during SLM. Based on the predicted temperature distributions, melt pool geometry, i.e. the locations at which melting of the powder material occurs, is determined. Simulation results are compared against data obtained from experimental Inconel 625 test coupons fabricated at the National
Lafaysse, M.; Hingray, B.; Etchevers, P.; Martin, E.; Obled, C.
2011-06-01
SummaryThe SAFRAN-ISBA-MODCOU hydrological model ( Habets et al., 2008) presents severe limitations for alpine catchments. Here we propose possible model adaptations. For the catchment discretization, Relatively Homogeneous Hydrological Units (RHHUs) are used instead of the classical 8 km square grid. They are defined from the dilineation of hydrological subbasins, elevation bands, and aspect classes. Glacierized and non-glacierized areas are also treated separately. In addition, new modules are included in the model for the simulation of glacier melt, and retention of underground water. The improvement resulting from each model modification is analysed for the Upper Durance basin. RHHUs allow the model to better account for the high spatial variability of the hydrological processes (e.g. snow cover). The timing and the intensity of the spring snowmelt floods are significantly improved owing to the representation of water retention by aquifers. Despite the relatively small area covered by glaciers, accounting for glacier melt is necessary for simulating the late summer low flows. The modified model is robust over a long simulation period and it produces a good reproduction of the intra and interannual variability of discharge, which is a necessary condition for its application in a modified climate context.
Interfacial melting of ice under a high-speed slider: real-time visualization and friction modeling
Kim, Hyung-Seok; Yun, Chang-Ho; Kim, Dong-Jo; Kim, Ho-Young
2016-11-01
When a solid plate slides on ice, frictional heat melts asperities on the ice surface causing the real contact area to increase. Previous studies indicate the significance of contact area growth for ice friction, yet its quantitative understanding is far from clear mainly because the direct observation of the melting process at the interface has been extremely difficult. Here we describe a novel experimental setup that visualizes the interface of a rapidly rotating ice disc (up to the linear velocity of 10 m/s) and a transparent quartz surface in real time using the total internal reflection. We find that the melted area of the ice surface is a sensitive function of both sliding speed and temperature. We rationalize such quantitative measurements numerically and analytically, which allows us to predict the friction coefficient of ice as a function of relative velocity and temperature. This work can be used to develop friction-controlling mechanisms on ice surface, which are important in traffic safety as well as winter sports.
International Nuclear Information System (INIS)
Tran, Chi Thanh
2009-09-01
Severe accidents in a Light Water Reactor (LWR) have been a subject of intense research for the last three decades. The research in this area aims to reach understanding of the inherent physical phenomena and reduce the uncertainties in their quantification, with the ultimate goal of developing models that can be applied to safety analysis of nuclear reactors, and to evaluation of the proposed accident management schemes for mitigating the consequences of severe accidents. In a hypothetical severe accident there is likelihood that the core materials will be relocated to the lower plenum and form a decay-heated debris bed (debris cake) or a melt pool. Interactions of core debris or melt with the reactor structures depend to a large extent on the debris bed or melt pool thermal hydraulics. In case of inadequate cooling, the excessive heat would drive the structures' overheating and ablation, and hence govern the vessel failure mode and timing. In turn, threats to containment integrity associated with potential ex-vessel steam explosions and ex-vessel debris uncoolability depend on the composition, superheat, and amount of molten corium available for discharge upon the vessel failure. That is why predictions of transient melt pool heat transfer in the reactor lower head, subsequent vessel failure modes and melt characteristics upon the discharge are of paramount importance for plant safety assessment. The main purpose of the present study is to develop a method for reliable prediction of melt pool thermal hydraulics, namely to establish a computational platform for cost-effective, sufficiently-accurate numerical simulations and analyses of core Melt-Structure-Water Interactions in the LWR lower head during a postulated severe core-melting accident. To achieve the goal, an approach to efficient use of Computational Fluid Dynamics (CFD) has been proposed to guide and support the development of models suitable for accident analysis. The CFD method, on the one hand, is
He, Lijuan
2014-04-01
The deep subduction of the Pacific Plate underneath East Asia is thought to have played a key role in the destruction of the North China Craton (NCC). To test this hypothesis, this paper presents a new 2-D model that includes an initial stable equilibrated craton, the formation of a big mantle wedge (BMW), and erosion by vigorous mantle convection. The model shows that subduction alone cannot thin the cold solid craton, but it can form a low-viscosity BMW. The amount of convective erosion is directly proportional to viscosity within the BMW (η0bmw), and the rheological boundary layer thins linearly with decreasing log10(η0bmw), thereby contributing to an increase in heat flow at the lithospheric base. This model also differs from previous modeling in that the increase in heat flow decays linearly with t1/2, meaning that the overall thinning closely follows a natural log relationship over time. Nevertheless, convection alone can only cause a limited thinning due to a minor increase in basal heat flow. The lowering of melting temperature by peridotite-melt interaction can accelerate thinning during the early stages of this convection. The two combined actions can thin the craton significantly over tens of Myr. This modeling, combined with magmatism and heat flow data, indicates that the NCC evolution has involved four distinct stages: modification in the Jurassic by Pacific Plate subduction and BMW formation, destruction during the Early Cretaceous under combined convective erosion and peridotite-melt interaction, extension in the Late Cretaceous, and cooling since the late Cenozoic.
Shrestha, M.; Koike, T.; Xue, Y.; Wang, L.; Hirabayashi, Y.
2014-12-01
High mountain river basins in Hindukush Karakoram and Himalaya (HKH) regions are considered as 'water towers' of Asia with abundant source of fresh water as snow and glaciers. Upper Indus basin is one of the mega scale river basin in HKH region where snow and glaciermelt runoff is the major contributor to the annual runoff. The hostile climate, remote and extreme rough topography imposes many restraints regarding hydro-meteorological and glaciological observations, leading towards limited understanding of hydrological processes of river basins in this region. It is vital to integrate snow and glacier melt processes in a distributed biosphere hydrological framework to estimate the snow and glacier melt runoff and to quantify the river flow composition (snowmelt, glacier melt and rainfall contribution). An integrated system of distributed biosphere hydrological modeling framework with multilayer energy balance based snow and glaciermelt runoff schemes (WEB-DHM-S model) was implemented at Upper Indus basin (207300 km2) with a spatial resolution of 1 km and temporal resolution of an hour. Model input were meteorological forcing from Global Land Data Assimilation System (GLDAS), APHRODITE precipitation and de-trended gridded air temperature from observations. Simulations were carried out for two hydrological years (2002-2003). Discharge simulation results at multiple gauges showed good agreement with the observed one having Nash efficiency at 0.86. The spatial distribution of snow cover is simulated well as compared to the Moderate Resolution Imaging Spectroradiometer (MODIS) derived eight-day maximum snow-cover extent data (MOD10A2). Model accuracy, overestimation error and underestimation error in snow cover simulation were obtained at 78%, 7% and 15% respectively. Uncertainty in precipitation was the main reason for the biases in seasonal variation of snow pixel errors. The model demonstrated its sound capability in comprehensive simulation of discharge with its flow
Cubero Postigo, G
1988-11-01
In this study about melting and torchs employed in solder in fixed prosthodontics, it's analysed the accurate melting, adequate quantity, as well as protection of adjacent tissues with an accurate anti-melting. The torch chosen is the oxyacetylene burner, because its greater calorific power.
Nonlinear modeling of crystal system transition of black phosphorus using continuum-DFT model
Setoodeh, A. R.; Farahmand, H.
2018-01-01
In this paper, the nonlinear behavior of black phosphorus crystals is investigated in tandem with dispersion-corrected density functional theory (DFT-D) analysis under uniaxial loadings. From the identified anisotropic behavior of black phosphorus due to its morphological anisotropy, a hyperelastic anisotropic (HA) model named continuum-DFT is established to predict the nonlinear behavior of the material. In this respect, uniaxial Cauchy stresses are employed on both the DFT-D and HA models along the zig-zag and armchair directions. Simultaneously, the transition of the crystal system is recognized at about 4.5 GPa of the applied uniaxial tensile stress along the zig-zag direction on the DFT-D simulation in the nonlinear region. In order to develop the nonlinear continuum model, unknown constants are surveyed with the optimized least square technique. In this regard, the continuum model is obtained to reproduce the Cauchy stress–stretch and density of strain–stretch results of the DFT-D simulation. Consequently, the modified HA model is introduced to characterize the nonlinear behavior of black phosphorus along the zig-zag direction. More importantly, the specific transition of the crystal system is successfully predicted in the new modified continuum-DFT model. The results reveal that the multiscale continuum-DFT model is well defined to replicate the nonlinear behavior of black phosphorus along the zig-zag and armchair directions.
Nonlinear modeling of crystal system transition of black phosphorus using continuum-DFT model.
Setoodeh, A R; Farahmand, H
2018-01-24
In this paper, the nonlinear behavior of black phosphorus crystals is investigated in tandem with dispersion-corrected density functional theory (DFT-D) analysis under uniaxial loadings. From the identified anisotropic behavior of black phosphorus due to its morphological anisotropy, a hyperelastic anisotropic (HA) model named continuum-DFT is established to predict the nonlinear behavior of the material. In this respect, uniaxial Cauchy stresses are employed on both the DFT-D and HA models along the zig-zag and armchair directions. Simultaneously, the transition of the crystal system is recognized at about 4.5 GPa of the applied uniaxial tensile stress along the zig-zag direction on the DFT-D simulation in the nonlinear region. In order to develop the nonlinear continuum model, unknown constants are surveyed with the optimized least square technique. In this regard, the continuum model is obtained to reproduce the Cauchy stress-stretch and density of strain-stretch results of the DFT-D simulation. Consequently, the modified HA model is introduced to characterize the nonlinear behavior of black phosphorus along the zig-zag direction. More importantly, the specific transition of the crystal system is successfully predicted in the new modified continuum-DFT model. The results reveal that the multiscale continuum-DFT model is well defined to replicate the nonlinear behavior of black phosphorus along the zig-zag and armchair directions.
Bifurcation analysis and dimension reduction of a predator-prey model for the L-H transition
DEFF Research Database (Denmark)
Dam, Magnus; Brøns, Morten; Juul Rasmussen, Jens
2013-01-01
The L-H transition denotes a shift to an improved confinement state of a toroidal plasma in a fusion reactor. A model of the L-H transition is required to simulate the time dependence of tokamak discharges that include the L-H transition. A 3-ODE predator-prey type model of the L-H transition...
Directory of Open Access Journals (Sweden)
Buddhi Arachchige
2017-11-01
Full Text Available This paper focuses on predicting the End of Life and End of Discharge of Lithium ion batteries using a battery capacity fade model and a battery discharge model. The proposed framework will be able to estimate the Remaining Useful Life (RUL and the Remaining charge through capacity fade and discharge models. A particle filter is implemented that estimates the battery’s State of Charge (SOC and State of Life (SOL by utilizing the battery’s physical data such as voltage, temperature, and current measurements. The accuracy of the prognostic framework has been improved by enhancing the particle filter state transition model to incorporate different environmental and loading conditions without retuning the model parameters. The effect of capacity fade in the reduction of the EOD (End of Discharge time with cycling has also been included, integrating both EOL (End of Life and EOD prediction models in order to get more accuracy in the estimations.
A Smooth Transition Logit Model of the Effects of Deregulation in the Electricity Market
DEFF Research Database (Denmark)
Hurn, A.S.; Silvennoinen, Annastiina; Teräsvirta, Timo
We consider a nonlinear vector model called the logistic vector smooth transition autoregressive model. The bivariate single-transition vector smooth transition regression model of Camacho (2004) is generalised to a multivariate and multitransition one. A modelling strategy consisting of specific......We consider a nonlinear vector model called the logistic vector smooth transition autoregressive model. The bivariate single-transition vector smooth transition regression model of Camacho (2004) is generalised to a multivariate and multitransition one. A modelling strategy consisting...... of specification, including testing linearity, estimation and evaluation of these models is constructed. Nonlinear least squares estimation of the parameters of the model is discussed. Evaluation by misspecification tests is carried out using tests derived in a companion paper. The use of the modelling strategy...... is illustrated by two applications. In the first one, the dynamic relationship between the US gasoline price and consumption is studied and possible asymmetries in it considered. The second application consists of modelling two well known Icelandic riverflow series, previously considered by many hydrologists...
On phase transitions of the Potts model with three competing interactions on Cayley tree
Directory of Open Access Journals (Sweden)
S. Temir
2011-06-01
Full Text Available In the present paper we study a phase transition problem for the Potts model with three competing interactions, the nearest neighbors, the second neighbors and triples of neighbors and non-zero external field on Cayley tree of order two. We prove that for some parameter values of the model there is phase transition. We reduce the problem of describing by limiting Gibbs measures to the problem of solving a system of nonlinear functional equations. We extend the results obtained by Ganikhodjaev and Rozikov [Math. Phys. Anal. Geom., 2009, vol. 12, No. 2, 141-156] on phase transition for the Ising model to the Potts model setting.
Micoulaut, Matthieu
2010-07-21
A low temperature Monte Carlo dynamics of a Keating-like oscillator model is used to study the relationship between the nature of network glasses from the viewpoint of rigidity, the thermal reversibility during the glass transition and the strong-fragile behaviour of glass-forming liquids. The model shows that a Phillips optimal glass formation with minimal enthalpic changes is obtained under a cooling/annealing cycle when the system is optimally constrained by the harmonic interactions, i.e. when it is isostatically rigid. For these peculiar systems with a nearly reversible glass transition, the computed activation energy for relaxation time shows also a minimum, which demonstrates that isostatically rigid glasses are strong (Arrhenius-like) glass-forming liquids. Experiments on chalcogenide and oxide glass-forming liquids are discussed under this new perspective and confirm the theoretical prediction for chalcogenide network glasses whereas limitations of the approach appear for weakly interacting (non-covalent, ionic) systems.
Comparison of L-H transition measurements with physics models
International Nuclear Information System (INIS)
Carlstrom, T.N.; Burrell, K.H.; Groebner, R.J.
2001-01-01
Sawteeth and neutrals are found to have a significant influence on the H-mode power threshold scaling. The ion ∇B drift direction has only a small effect on the edge plasma conditions measured near the plasma midplane but a large effect on the divertor plasma. Since the power threshold changes dramatically with the direction of the ion ∇B drift, this implies that phenomena in the divertor region are critical for the L-H transition. Local conditions at the plasma edge are consistent with several theories of the L-H transition that use edge gradients in their formulation of a critical threshold parameter. However, scatter in the database is too large to distinguish between conditions that lead to an L-H transition and those that remain in L-mode. (author)
Comparison of L-H transition measurements with physics models
International Nuclear Information System (INIS)
Carlstrom, T.N.; Burrell, K.H.; Carreras, B.A.
1999-01-01
Sawteeth and neutrals are found to have a significant influence on the H-mode power threshold scaling. The ion ∇B drift direction has only a small effect on the edge plasma conditions measured near the plasma midplane but a large effect on the divertor plasma. Since the power threshold changes dramatically with the direction of the ion ∇B drift, this implies that phenomena in the divertor region are critical for the L-H transition. Local conditions at the plasma edge are consistent with several theories of the L-H transition that use edge gradients in their formulation of a critical threshold parameter. However, scatter in the database is too large to distinguish between conditions that lead to an L-H transition and those that remain in L-mode. (author)
High Pressure phase transition in some alkali halides using interatomic potential model
International Nuclear Information System (INIS)
Yazar, H.R.
2002-01-01
We have predicted the phase transition pressure in some alkali halides using an interatomic potential approach based on rigid ion model.The phase transition pressures(28.69 and 2.4 GPa) obtained by us for two alkali halides (NaCl and KCl ) are in closer agreement with their corresponding experimental data(29.0 and 2.0 GPa).This potential is promising with respect to prediction of the phase transition pressure of other alkali halides as well
Comparison of L-H transition measurements with physics models
International Nuclear Information System (INIS)
Carlstrom, T.N.; Burrell, K.H.; Groebner, R.J.; Leonard, A.W.; Osborne, T.H.; Thomas, D.M.
1998-12-01
A technique of fitting a modified hyperbolic tangent to the edge profiles has improved the localization of plasma edge parameters. Non-dimensional edge parameters are broadly consistent with several theories of the L-H transition that use edge gradients in their formulation of a critical threshold parameter. The ion ∇B drift direction has only a small effect on the edge plasma conditions measured near the plasma midplane but a large effect on the divertor plasma. The dramatic change of power threshold with the direction of the ion ∇B drift implies that phenomena in the divertor region may be critical for the L-H transition
Retrieving original melt compositions in migmatites
Kriegsman, L. M.; Nyström, A. I.
2003-04-01
The final textures and mineral modes of anatectic migmatites are affected by four successive processes: (i) prograde partial melting and small-scale segregation into melt-rich domains and restitic domains; (ii) partial melt extraction; (iii) partial retrograde reactions (back reaction) between in situ crystallizing melt and the restite; (iv) crystallization of remaining melt at the water-saturated solidus, releasing volatiles (Kriegsman, 2001). These processes are investigated using mass balance calculations in the KFMASH chemical system. Starting from a fixed bulk composition, fluid-absent melting reactions are considered along an isobaric heating path, followed by mineral-melt reactions during isobaric cooling (path 1), and uplift (path 2). Variables in the model are the restite fraction X and the melt fraction Y involved in back reaction, the melt fraction Z extracted from the system, and the melt fraction 1-Y-Z crystallized in situ at the water-saturated solidus. Incongruent phases are considered to be part of the restite. To facilitate calculations, mineral and melt compositions are taken to be constant. It is shown that melanosome, leucosome, and mesosome compositions generally do not show linear compositional trends in a closed system. Instead, mesosome, neosome, protolith and melt compositions lie on a hyperplane and form linear trends in any compositional diagram. Several methods are proposed to retrieve the melt composition from neosome and mesosome compositions. Applications to natural examples (dataset of Ashworth, 1976; and our new data from SW Finland) strengthen the migmatite-to-granite connection which may notably be obscured by the back reaction process. References: Kriegsman, L.M., 2001, Lithos 56, 75-96 Ashworth, J.R., 1976. Mineralogical Magazine 40, 661-682
Sound velocity variations and melting of vanadium under shock compression
International Nuclear Information System (INIS)
Dai Chengda; Jin Xiaogang; Zhou Xianming; Liu Jianjun; Hu Jinbiao
2001-01-01
The sound velocities of vanadium at shock pressure ranging from 154 to 250 GPa were determined using transparent-window optical analyser techniques. A discontinuity in sound velocities at about 225 GPa may mark the partial melting under shock compression. The comparison between the measured sound velocity data sets above ∼225 GPa and calculated values yields γ 0 ∼2.0 and the empirical expression γρ=γ 0 ρ 0 is basically tenable. Additionally, shock temperatures along the principal Hugoniot of vanadium were also determined from interfacial radiation intensities according to Grover's ideal interface model. Thus the temperature at this solid-liquid phase transition was constrained to be round about 7800(±800) K on the basis of the measured Hugoniot temperatures, melting temperatures, and high-pressure sound velocity variations with pressure. (author)
Pattyn, Frank
2017-08-01
The magnitude of the Antarctic ice sheet's contribution to global sea-level rise is dominated by the potential of its marine sectors to become unstable and collapse as a response to ocean (and atmospheric) forcing. This paper presents Antarctic sea-level response to sudden atmospheric and oceanic forcings on multi-centennial timescales with the newly developed fast Elementary Thermomechanical Ice Sheet (f.ETISh) model. The f.ETISh model is a vertically integrated hybrid ice sheet-ice shelf model with vertically integrated thermomechanical coupling, making the model two-dimensional. Its marine boundary is represented by two different flux conditions, coherent with power-law basal sliding and Coulomb basal friction. The model has been compared to existing benchmarks. Modelled Antarctic ice sheet response to forcing is dominated by sub-ice shelf melt and the sensitivity is highly dependent on basal conditions at the grounding line. Coulomb friction in the grounding-line transition zone leads to significantly higher mass loss in both West and East Antarctica on centennial timescales, leading to 1.5 m sea-level rise after 500 years for a limited melt scenario of 10 m a-1 under freely floating ice shelves, up to 6 m for a 50 m a-1 scenario. The higher sensitivity is attributed to higher ice fluxes at the grounding line due to vanishing effective pressure. Removing the ice shelves altogether results in a disintegration of the West Antarctic ice sheet and (partially) marine basins in East Antarctica. After 500 years, this leads to a 5 m and a 16 m sea-level rise for the power-law basal sliding and Coulomb friction conditions at the grounding line, respectively. The latter value agrees with simulations by DeConto and Pollard (2016) over a similar period (but with different forcing and including processes of hydrofracturing and cliff failure). The chosen parametrizations make model results largely independent of spatial resolution so that f.ETISh can potentially be
International Nuclear Information System (INIS)
Dai, Donghua; Gu, Dongdong
2014-01-01
Highlights: • Thermal behavior and densification activity during SLM of composites are simulated. • Temperature distributions and melt pool dimensions during SLM are disclosed. • Motion behaviors of gaseous bubbles in laser induced melt pool are elucidated. • Simulation results show good agreement with the obtained experimental results. - Abstract: Simulation of temperature distribution and densification process of selective laser melting (SLM) WC/Cu composite powder system has been performed, using a finite volume method (FVM). The transition from powder to solid, the surface tension induced by temperature gradient, and the movement of laser beam power with a Gaussian energy distribution are taken into account in the physical model. The effect of the applied linear energy density (LED) on the temperature distribution, melt pool dimensions, behaviors of gaseous bubbles and resultant densification activity has been investigated. It shows that the temperature distribution is asymmetric with respect to the laser beam scanning area. The center of the melt pool does not locate at the center of the laser beam but slightly shifts towards the side of the decreasing X-axis. The dimensions of the melt pool are in sizes of hundreds of micrometers and increase with the applied LED. For an optimized LED of 17.5 kJ/m, an enhanced efficiency of gas removal from the melt pool is realized, and the maximum relative density of laser processed powder reaches 96%. As the applied LED surpasses 20 kJ/m, Marangoni flow tends to retain the entrapped gas bubbles. The flow pattern has a tendency to deposit the gas bubbles at the melt pool bottom or to agglomerate gas bubbles by the rotating flow in the melt pool, resulting in a higher porosity in laser processed powder. The relative density and corresponding pore size and morphology are experimentally acquired, which are in a good agreement with the results predicted by simulation
Small angle neutron scattering form polymer melts: structural investigation and phase behaviour
International Nuclear Information System (INIS)
Ertugrul, O.
2004-01-01
The Small-Angle Neutron Scattering (SANS) techniques have been used to study the structural properties and phase behavior of polymer melts. A model based on Random Phase Approximation (RPA) is proposed to predict the experimental data. By fitting the model to data we could be able to obtain radius of gyration (a measure of size of a polymer) and phase transition for the sample. (author)
Hierarchical Colored Petri Nets for Modeling and Analysis of Transit Signal Priority Control Systems
Directory of Open Access Journals (Sweden)
Yisheng An
2018-01-01
Full Text Available In this paper, we consider the problem of developing a model for traffic signal control with transit priority using Hierarchical Colored Petri nets (HCPN. Petri nets (PN are useful for state analysis of discrete event systems due to their powerful modeling capability and mathematical formalism. This paper focuses on their use to formalize the transit signal priority (TSP control model. In a four-phase traffic signal control model, the transit detection and two kinds of transit priority strategies are integrated to obtain the HCPN-based TSP control models. One of the advantages to use these models is the clear presentation of traffic light behaviors in terms of conditions and events that cause the detection of a priority request by a transit vehicle. Another advantage of the resulting models is that the correctness and reliability of the proposed strategies are easily analyzed. After their full reachable states are generated, the boundness, liveness, and fairness of the proposed models are verified. Experimental results show that the proposed control model provides transit vehicles with better effectiveness at intersections. This work helps advance the state of the art in the design of signal control models related to the intersection of roadways.
Description of radiative transitions in the relativistic string model
International Nuclear Information System (INIS)
Berdnikov, E.B.; Nanobashvili, G.G.; Pron'ko, G.P.
1991-01-01
The transition operator for a straight-line string in the electromagnetic field has been built. It's matrix elements between the states of arbitrary spin are calculated in lowest order of perturbation theory. The consistensy conditions for the operator of interaction arising due to quantum constraints are also discussed. 12 refs
International Nuclear Information System (INIS)
Le Guen, E.
2010-11-01
Hybrid laser/MIG-MAG welding shows high advantages compared to laser welding or GMAW arc welding used separately. Thanks to this process, higher productivity can be gained through higher welding speed, higher squeeze tolerance moreover possible improvement of the metallurgical properties of the weld seam can be obtained. However, many operating parameters have to be set up in order to achieve optimal process. The complex physical phenomena, which govern welding process, have to be understood in order to use efficiently this technique in mass production. Understanding of these phenomena is also necessary to program numerical simulations which fit to this process. In the first step, experimental studies have been carried out with GMAW, laser and hybrid welding on samples of S355 steel. Influence of operating parameters has been analyzed through films performed with speed camera and macro-graphies of weld seam cross section. Surface deformations of the melt pool, induced by the arc pressure, weld pool length, droplet detachment and welding speed, have been analyzed precisely from images of the surface melt pool. In a second step, a numerical model was developed using the COMSOL Multiphysics software for MAG, laser and hybrid laser/MAG welding processes. A 3D quasi-stationary model has been calculated from the temperature field within the metal. The originality of the MAG and hybrid model lies in the prediction of the melt pool surface profile used to determine the 3D geometry, by taking into account the material input. The influence of different parameters such as arc power and speed welding on the efficiency as well as the distribution radius of the arc power and the arc pressure are analyzed through validations with different experimental results and different calculation configurations. (author)
Comparisons of seismic and electromagnetic structures of the MELT area
Evans, R. L.; Hirth, G.; Forsyth, D.; Baba, K.; Chave, A.
2003-04-01
Both seismic and electromagnetic (EM) models from the MELT experiment show similar broad scale features in the mantle beneath the Southern EPR. In all EM models, the conductivity in the upper 50-60˜km is considerably higher to the west of the ridge than to the east. Similarly, seismic models of short period Love waves are asymmetric in velocity structure, with slower velocities to the west of the ridge within the upper 60˜km. Body wave data suggest a similar asymmetry, although the depth extent is not as well defined. West of the ridge, both the higher conductivities and lower velocities have been attributed to the presence of a small melt fraction, although the anomalous regions estimated from different techniques do not entirely agree. To the east, there is a rapid increase in resistivity and S-wave velocity, indicating that within 25˜km of the axis the mantle above 70˜km is both dry and melt-free. Further away from the ridge, the boundary between a conductive asthenospheric mantle and a resistive overlying mantle flattens, at a depth around 60-80˜km. Rayleigh wave inversions also show fairly flat velocity contours with a broad minimum centered at 60-80˜km. Both of these features are consistent with a transition from dry to damp mantle. Also away from the ridge, EM data, shear-wave splitting, and Rayleigh waves all require an azimuthally anisotropic mantle consistent with the a-axis of olivine being preferentially oriented horizontally and perpendicular to the ridge. Anisotropy in EM data suggests damp mantle conditions in the 100-200˜km depth range, with enhanced conduction along the a-axis of olivine. Rayleigh waves are most sensitive to shallower structure and require anisotropy in the upper 70˜km. In the uppermost 40˜km, the most conductive and lowest velocity regions are close to the axis but offset 5-10˜km to the west. Some anisotropic inversions recover a vertically conductive feature that could be interpreted as a few percent melt distributed in
Gaussian wave packet dynamics and the Landau-Zener model for nonadiabatic transitions
DEFF Research Database (Denmark)
Henriksen, Niels Engholm
1992-01-01
The Landau-Zener model for transitions between two linear diabatic potentials is examined. We derive, in the weak-coupling limit, an expression for the transition probability where the classical trajectory and the constant velocity approximations are abandoned and replaced by quantum dynamics...
van Oort, N.; Brands, Ties; de Romph, E.; Aceves Flores, J.
2014-01-01
Nowadays, transport demand models do not explicitly evaluate the impacts of service reliability of transit. Service reliability of transit systems is adversely experienced by users, as it causes additional travel time and unsecure arrival times. Because of this, travelers are likely to perceive a
A latent transition model of the effects of a teen dating violence prevention initiative.
Williams, Jason; Miller, Shari; Cutbush, Stacey; Gibbs, Deborah; Clinton-Sherrod, Monique; Jones, Sarah
2015-02-01
Patterns of physical and psychological teen dating violence (TDV) perpetration, victimization, and related behaviors were examined with data from the evaluation of the Start Strong: Building Healthy Teen Relationships initiative, a dating violence primary prevention program targeting middle school students. Latent class and latent transition models were used to estimate distinct patterns of TDV and related behaviors of bullying and sexual harassment in seventh grade students at baseline and to estimate transition probabilities from one pattern of behavior to another at the 1-year follow-up. Intervention effects were estimated by conditioning transitions on exposure to Start Strong. Latent class analyses suggested four classes best captured patterns of these interrelated behaviors. Classes were characterized by elevated perpetration and victimization on most behaviors (the multiproblem class), bullying perpetration/victimization and sexual harassment victimization (the bully-harassment victimization class), bullying perpetration/victimization and psychological TDV victimization (bully-psychological victimization), and experience of bully victimization (bully victimization). Latent transition models indicated greater stability of class membership in the comparison group. Intervention students were less likely to transition to the most problematic pattern and more likely to transition to the least problem class. Although Start Strong has not been found to significantly change TDV, alternative evaluation models may find important differences. Latent transition analysis models suggest positive intervention impact, especially for the transitions at the most and the least positive end of the spectrum. Copyright © 2015. Published by Elsevier Inc.
Weak first-order orientational transition in the Lebwohl-Lasher model for liquid crystals
DEFF Research Database (Denmark)
Zhang, Zhengping; Mouritsen, Ole G.; Zuckermann, Martin J.
1992-01-01
The nature of the orientational phase transition in the three-dimensional Lebwohl-Lasher model of liquid crystals has been studied by computer simulation using reweighting techniques and finite-size scaling analysis. Unambiguous numerical evidence is found in favor of a weak first-order transition...
Boundary-layer transition prediction using a simplified correlation-based model
Directory of Open Access Journals (Sweden)
Xia Chenchao
2016-02-01
Full Text Available This paper describes a simplified transition model based on the recently developed correlation-based γ-Reθt transition model. The transport equation of transition momentum thickness Reynolds number is eliminated for simplicity, and new transition length function and critical Reynolds number correlation are proposed. The new model is implemented into an in-house computational fluid dynamics (CFD code and validated for low and high-speed flow cases, including the zero pressure flat plate, airfoils, hypersonic flat plate and double wedge. Comparisons between the simulation results and experimental data show that the boundary-layer transition phenomena can be reasonably illustrated by the new model, which gives rise to significant improvements over the fully laminar and fully turbulent results. Moreover, the new model has comparable features of accuracy and applicability when compared with the original γ-Reθt model. In the meantime, the newly proposed model takes only one transport equation of intermittency factor and requires fewer correlations, which simplifies the original model greatly. Further studies, especially on separation-induced transition flows, are required for the improvement of the new model.
Directory of Open Access Journals (Sweden)
M. C. Roa-García
2010-08-01
Full Text Available We present a new modeling approach analyzing and predicting the Transit Time Distribution (TTD and the Response Time Distribution (RTD from hourly to annual time scales as two distinct hydrological processes. The model integrates Isotope Hydrograph Separation (IHS and the Instantaneous Unit Hydrograph (IUH approach as a tool to provide a more realistic description of transit and response time of water in catchments. Individual event simulations and parameterizations were combined with long-term baseflow simulation and parameterizations; this provides a comprehensive picture of the catchment response for a long time span for the hydraulic and isotopic processes. The proposed method was tested in three Andean headwater catchments to compare the effects of land use on hydrological response and solute transport. Results show that the characteristics of events and antecedent conditions have a significant influence on TTD and RTD, but in general the RTD of the grassland dominated catchment is concentrated in the shorter time spans and has a higher cumulative TTD, while the forest dominated catchment has a relatively higher response distribution and lower cumulative TTD. The catchment where wetlands concentrate shows a flashier response, but wetlands also appear to prolong transit time.
International Nuclear Information System (INIS)
Geist, G.A.; Wood, R.F.
1985-11-01
The conceptual foundation of a computational model and a computer program based on it have been developed for treating various aspects of the complex melting and solidification behavior observed in pulsed laser-irradiated materials. A particularly important feature of the modeling is the capability of allowing melting and solidification to occur at temperatures other than the thermodynamic phase change temperatures. As a result, interfacial undercooling and overheating can be introduced and various types of nucleation events can be simulated. Calculations on silicon with the model have shown a wide variety of behavior, including the formation and propagation of multiple phase fronts. Although originally developed as a tool for studying certain problems arising in the field of laser annealing of semiconductors, the program should be useful in treating many types of systems in which phase changes and nucleation phenomena play important roles. This report describes the underlying physical and mathematical ideas and the basic relations used in LASER8. It also provides enough specific and detailed information on the program to serve as a guide for its use; a listing of one version of the program is given
Quintavalle, U; Voinovich, D; Perissutti, B; Serdoz, F; Grassi, G; Dal Col, A; Grassi, M
2008-03-03
Aim of this work was to develop a cylindrical co-extrudate characterised by an in vivo sustained release profile by means of a hot-melt extrusion process. Co-extrudate was made up of two concentric extruded matrices: an inner one having a hydrophilic character, based on polyethylene glycol, and an outer one with lipophilic character, based on microcrystalline wax. Both segments contained theophylline as a model drug. A screening between several devices differing for dimensions (diameter and length) and relative proportions of the inner and outer part was carried out on the basis of their in vitro drug release and the release mechanism was studied by means of a mathematical model. The co-extrudate exhibiting the desired sustained release was selected for in vivo bioavailability studies. In vivo studies confirmed the achievement of the purpose of the research, demonstrating the desired release of theophylline on four healthy volunteers. Accordingly, hot-melt extrusion process is a viable method to produce in a single step co-extrudates showing a sustained release. In addition, the developed mathematical model proved to be a reliable descriptor of the both in vitro and in vivo experimental data.
Chen, Pei; Liu, Rui; Li, Yongjun; Chen, Luonan
2016-07-15
Identifying the critical state or pre-transition state just before the occurrence of a phase transition is a challenging task, because the state of the system may show little apparent change before this critical transition during the gradual parameter variations. Such dynamics of phase transition is generally composed of three stages, i.e. before-transition state, pre-transition state and after-transition state, which can be considered as three different Markov processes. By exploring the rich dynamical information provided by high-throughput data, we present a novel computational method, i.e. hidden Markov model (HMM) based approach, to detect the switching point of the two Markov processes from the before-transition state (a stationary Markov process) to the pre-transition state (a time-varying Markov process), thereby identifying the pre-transition state or early-warning signals of the phase transition. To validate the effectiveness, we apply this method to detect the signals of the imminent phase transitions of complex systems based on the simulated datasets, and further identify the pre-transition states as well as their critical modules for three real datasets, i.e. the acute lung injury triggered by phosgene inhalation, MCF-7 human breast cancer caused by heregulin and HCV-induced dysplasia and hepatocellular carcinoma. Both functional and pathway enrichment analyses validate the computational results. The source code and some supporting files are available at https://github.com/rabbitpei/HMM_based-method lnchen@sibs.ac.cn or liyj@scut.edu.cn Supplementary data are available at Bioinformatics online. © The Author 2016. Published by Oxford University Press. All rights reserved. For Permissions, please e-mail: journals.permissions@oup.com.
Arisoy, Yigit Muzaffer
Manufacturing processes may significantly affect the quality of resultant surfaces and structural integrity of the metal end products. Controlling manufacturing process induced changes to the product's surface integrity may improve the fatigue life and overall reliability of the end product. The goal of this study is to model the phenomena that result in microstructural alterations and improve the surface integrity of the manufactured parts by utilizing physics-based process simulations and other computational methods. Two different (both conventional and advanced) manufacturing processes; i.e. machining of Titanium and Nickel-based alloys and selective laser melting of Nickel-based powder alloys are studied. 3D Finite Element (FE) process simulations are developed and experimental data that validates these process simulation models are generated to compare against predictions. Computational process modeling and optimization have been performed for machining induced microstructure that includes; i) predicting recrystallization and grain size using FE simulations and the Johnson-Mehl-Avrami-Kolmogorov (JMAK) model, ii) predicting microhardness using non-linear regression models and the Random Forests method, and iii) multi-objective machining optimization for minimizing microstructural changes. Experimental analysis and computational process modeling of selective laser melting have been also conducted including; i) microstructural analysis of grain sizes and growth directions using SEM imaging and machine learning algorithms, ii) analysis of thermal imaging for spattering, heating/cooling rates and meltpool size, iii) predicting thermal field, meltpool size, and growth directions via thermal gradients using 3D FE simulations, iv) predicting localized solidification using the Phase Field method. These computational process models and predictive models, once utilized by industry to optimize process parameters, have the ultimate potential to improve performance of
Investigation of the stability of melt flow in gating systems
DEFF Research Database (Denmark)
Tiedje, Niels Skat; Larsen, Per
2011-01-01
Melt flow in four different gating systems designed for production of brake discs was analysed experimentally and by numerical modelling. In the experiments moulds were fitted with glass fronts and melt flow was recorded on video. The video recordings were compared with modelling of melt flow in ...
Latent Transition Analysis with a Mixture Item Response Theory Measurement Model
Cho, Sun-Joo; Cohen, Allan S.; Kim, Seock-Ho; Bottge, Brian
2010-01-01
A latent transition analysis (LTA) model was described with a mixture Rasch model (MRM) as the measurement model. Unlike the LTA, which was developed with a latent class measurement model, the LTA-MRM permits within-class variability on the latent variable, making it more useful for measuring treatment effects within latent classes. A simulation…
Retrograde Melting and Internal Liquid Gettering in Silicon
Energy Technology Data Exchange (ETDEWEB)
Hudelson, Steve; Newman, Bonna K.; Bernardis, Sarah; Fenning, David P.; Bertoni, Mariana I.; Marcus, Matthew A.; Fakra, Sirine C.; Lai, Barry; Buonassisi, Tonio
2011-07-01
Retrograde melting (melting upon cooling) is observed in silicon doped with 3d transition metals, via synchrotron-based temperature-dependent X-ray microprobe measurements. Liquid metal-silicon droplets formed via retrograde melting act as efficient sinks for metal impurities dissolved within the silicon matrix. Cooling results in decomposition of the homogeneous liquid phase into solid multiple-metal alloy precipitates. These phenomena represent a novel pathway for engineering impurities in semiconductor-based systems.
Volatile diffusion in silicate melts and its effects on melt inclusions
Directory of Open Access Journals (Sweden)
P. Scarlato
2005-06-01
Full Text Available A compendium of diffusion measurements and their Arrhenius equations for water, carbon dioxide, sulfur, fluorine, and chlorine in silicate melts similar in composition to natural igneous rocks is presented. Water diffusion in silicic melts is well studied and understood, however little data exists for melts of intermediate to basic compositions. The data demonstrate that both the water concentration and the anhydrous melt composition affect the diffusion coefficient of water. Carbon dioxide diffusion appears only weakly dependent, at most, on the volatilefree melt composition and no effect of carbon dioxide concentration has been observed, although few experiments have been performed. Based upon one study, the addition of water to rhyolitic melts increases carbon dioxide diffusion by orders of magnitude to values similar to that of 6 wt% water. Sulfur diffusion in intermediate to silicic melts depends upon the anhydrous melt composition and the water concentration. In water-bearing silicic melts sulfur diffuses 2 to 3 orders of magnitude slower than water. Chlorine diffusion is affected by both water concentration and anhydrous melt composition; its values are typically between those of water and sulfur. Information on fluorine diffusion is rare, but the volatile-free melt composition exerts a strong control on its diffusion. At the present time the diffusion of water, carbon dioxide, sulfur and chlorine can be estimated in silicic melts at magmatic temperatures. The diffusion of water and carbon dioxide in basic to intermediate melts is only known at a limited set of temperatures and compositions. The diffusion data for rhyolitic melts at 800°C together with a standard model for the enrichment of incompatible elements in front of growing crystals demonstrate that rapid crystal growth, greater than 10-10 ms-1, can significantly increase the volatile concentrations at the crystal-melt interface and that any of that melt trapped
Ocean stratification reduces melt rates at the grounding zone of the Ross Ice Shelf
Begeman, C. B.; Tulaczyk, S. M.; Marsh, O.; Mikucki, J.; Stanton, T. P.; Hodson, T. O.; Siegfried, M. R.; Powell, R. D.; Christianson, K. A.; King, M. A.
2017-12-01
Ocean-driven melting of ice shelves is often invoked as the primary mechanism for triggering ice loss from Antarctica. However, due to the difficulty in accessing the sub-ice-shelf ocean cavity, the relationship between ice-shelf melt rates and ocean conditions is poorly understood, particularly near the transition from grounded to floating ice, known as the grounding zone. Here we present the first borehole oceanographic observations from the grounding zone of Antarctica's largest ice shelf. Contrary to predictions that tidal currents near grounding zones should mix the water column, driving high ice-shelf melt rates, we find a stratified sub-ice-shelf water column. The vertical salinity gradient dominates stratification over a weakly unstable vertical temperature gradient; thus, stratification takes the form of a double-diffusive staircase. These conditions limit vertical heat fluxes and lead to low melt rates in the ice-shelf grounding zone. While modern grounding zone melt rates may presently be overestimated in models that assume efficient tidal mixing, the high sensitivity of double-diffusive staircases to ocean freshening and warming suggests future melt rates may be underestimated, biasing projections of global sea-level rise.
Calculation model for 16N transit time in the secondary side of steam generators
International Nuclear Information System (INIS)
Liu Songyu; Xu Jijun; Xu Ming
1998-01-01
The 16 N transit time is essential to determine the leak-rate of steam generator tubes leaks with 16 N monitoring system, which is a new technique. A model was developed for calculation 16 N transit time in the secondary side of steam generators. According to the flow characters of secondary side fluid, the transit times divide into four sectors from tube sheet to the sensor on steam line. The model assumes that 16 N is moving as vapor phase in the secondary-side. So the model for vapor velocity distribution in tube bundle is presented in detail. The 16 N transit time calculation results of this model compare with these of EDF on steam generator of Qinshan NPP
A multiple-field coupled resistive transition model for superconducting Nb3Sn
Directory of Open Access Journals (Sweden)
Lin Yang
2016-12-01
Full Text Available A study on the superconducting transition width as functions of the applied magnetic field and strain is performed in superconducting Nb3Sn. A quantitative, yet universal phenomenological resistivity model is proposed. The numerical simulation by the proposed model shows predicted resistive transition characteristics under variable magnetic fields and strain, which in good agreement with the experimental observations. Furthermore, a temperature-modulated magnetoresistance transition behavior in filamentary Nb3Sn conductors can also be well described by the given model. The multiple-field coupled resistive transition model is helpful for making objective determinations of the high-dimensional critical surface of Nb3Sn in the multi-parameter space, offering some preliminary information about the basic vortex-pinning mechanisms, and guiding the design of the quench protection system of Nb3Sn superconducting magnets.
A multiple-field coupled resistive transition model for superconducting Nb3Sn
Yang, Lin; Ding, He; Zhang, Xin; Qiao, Li
2016-12-01
A study on the superconducting transition width as functions of the applied magnetic field and strain is performed in superconducting Nb3Sn. A quantitative, yet universal phenomenological resistivity model is proposed. The numerical simulation by the proposed model shows predicted resistive transition characteristics under variable magnetic fields and strain, which in good agreement with the experimental observations. Furthermore, a temperature-modulated magnetoresistance transition behavior in filamentary Nb3Sn conductors can also be well described by the given model. The multiple-field coupled resistive transition model is helpful for making objective determinations of the high-dimensional critical surface of Nb3Sn in the multi-parameter space, offering some preliminary information about the basic vortex-pinning mechanisms, and guiding the design of the quench protection system of Nb3Sn superconducting magnets.
Nonequilibrium phase transition in a system with chaotic dynamics. The ABCDE model
Friedrich, R.; Haken, H.
1992-04-01
For the ABCDE model, a low-dimensional dynamical system devised to study the generation of magnetic fields by convective fluid motions, we examine a nonequilibrium phase transition in a system with chaotic dynamics.
Itraconazole formulation studies of the melt-extrusion process with mixture design.
Rambali, B; Verreck, G; Baert, L; Massart, D L
2003-07-01
Itraconazole is a poorly water soluble compound. One method to increase the aqueous solubility of itraconazole is through formation of a solid dispersion. The purpose of this study is to develop a 40% w/w itraconazole formulation through solid dispersion formation, using hydroxypropyl-beta-cyclodextrin (HP-beta-CD) and hydroxypropylmethyl-cellulose (HPMC) as mixture components. The solid dispersion was obtained by melt-extrusion using a twin-screw corotating melt extruder. A D-optimal mixture design was applied for the development of the optimal itraconazole formulation. The itraconazole fraction varied between 20% w/w and 50% w/w in the mixture design and the HPMC and HP-beta-CD fractions varied between 10% w/w and 60% w/w. The itraconazole formulation was optimized by producing clear extrudates, minimizing the torque, and maximizing the glass transition temperature and the apparent itraconazole solubility in 0.1 N HCl. Regression models were developed for the torque, glass transition temperature, and apparent solubility of itraconazole. High itraconazole fraction in the mixture promoted a better melt processing (minimizes torque). High HPMC fraction (>33% w/w) resulted in clear extrudates, indicating a solid dispersion and resulted in high glass transition temperature of the melt. High HP-beta-CD fraction resulted in increased apparent itraconazole solubility in 0.1 N HCl. The optimal itraconazole formulation consisted of 45% w/w HPMC and 15% HP-beta-CD w/w.
Peng, Q.; Liang, Y.
2008-12-01
To better understand the melting processes beneath the mid-ocean ridge, we developed a simple model for trace element fractionation during concurrent melting and melt migration in an upwelling steady-state mantle column. Based on petrologic considerations, we divided the upwelling mantle into two regions: a double- lithology upper region where high permeability dunite channels are embedded in a lherzolite/harzburgite matrix, and a single-lithology lower region that consists of partially molten lherzolite. Melt generated in the single lithology region migrates upward through grain-scale diffuse porous flow, whereas melt in the lherzolite/harzburgite matrix in the double-lithology region is allowed to flow both vertically through the overlying matrix and horizontally into its neighboring dunite channels. There are three key dynamic parameters in our model: degree of melting experienced by the single lithology column (Fd), degree of melting experienced by the double lithology column (F), and a dimensionless melt suction rate (R) that measures the accumulated rate of melt extraction from the matrix to the channel relative to the accumulated rate of matrix melting. In terms of trace element fractionation, upwelling and melting in the single lithology column is equivalent to non-modal batch melting (R = 0), whereas melting and melt migration in the double lithology region is equivalent to a nonlinear combination of non-modal batch and fractional melting (0 abyssal peridotite, we showed, with the help of Monte Carlo simulations, that it is difficult to invert for all three dynamic parameters from a set of incompatible trace element data with confidence. However, given Fd, it is quite possible to constrain F and R from incompatible trace element abundances in residual peridotite. As an illustrative example, we used the simple melting model developed in this study and selected REE and Y abundance in diopside from abyssal peridotites to infer their melting and melt migration
A Coupled Groundwater-Surface Water Modeling Framework for Simulating Transition Zone Processes.
Mugunthan, Pradeep; Russell, Kevin T; Gong, Binglei; Riley, Michael J; Chin, Arthur; McDonald, Blair G; Eastcott, Linda J
2017-05-01
There is an identified need for fully representing groundwater-surface water transition zone (i.e., the sediment zone that connects groundwater and surface water) processes in modeling fate and transport of contaminants to assist with management of contaminated sediments. Most existing groundwater and surface water fate and transport models are not dynamically linked and do not consider transition zone processes such as bioturbation and deposition and erosion of sediments. An interface module is developed herein to holistically simulate the fate and transport by coupling two commonly used models, Environmental Fluid Dynamics Code (EFDC) and SEAWAT, to simulate surface water and groundwater hydrodynamics, while providing an enhanced representation of the processes in the transition zone. Transition zone and surface water contaminant processes were represented through an enhanced version of the EFDC model, AQFATE. AQFATE also includes SEDZLJ, a state-of-the-science surface water sediment transport model. The modeling framework was tested on a published test problem and applied to evaluate field-scale two- and three-dimensional contaminant transport. The model accurately simulated concentrations of salinity from a published test case. For the field-scale applications, the model showed excellent mass balance closure for the transition zone and provided accurate simulations of all transition zone processes represented in the modeling framework. The model predictions for the two-dimensional field case were consistent with site-specific observations of contaminant migration. This modeling framework represents advancement in the simulation of transition zone processes and can help inform risk assessment at sites where contaminant sources from upland areas have the potential to impact sediments and surface water. © 2016, National Ground Water Association.
3D CFD computations of trasitional flows using DES and a correlation based transition model
DEFF Research Database (Denmark)
Sørensen, Niels N.; Bechmann, Andreas; Zahle, Frederik
2011-01-01
The present article describes the application of the correlation based transition model of Menter et al. in combination with the Detached Eddy Simulation (DES) methodology to two cases with large degree of flow separation typically considered difficult to compute. Firstly, the flow is computed over....... Secondly, the flow is computed over a thick airfoil at high angle of attack, in this case the DU-96-W351 is considered. These computations show that a transition model is needed to obtain correct drag predictions at low angle of attack, and that the combination of transition and the DES method improve...
Application of the algebraic RNG model for transition simulation. [renormalization group theory
Lund, Thomas S.
1990-01-01
The algebraic form of the RNG model of Yakhot and Orszag (1986) is investigated as a transition model for the Reynolds averaged boundary layer equations. It is found that the cubic equation for the eddy viscosity contains both a jump discontinuity and one spurious root. A yet unpublished transformation to a quartic equation is shown to remove the numerical difficulties associated with the discontinuity, but only at the expense of merging both the physical and spurious root of the cubic. Jumps between the branches of the resulting multiple-valued solution are found to lead to oscillations in flat plate transition calculations. Aside from the oscillations, the transition behavior is qualitatively correct.
Melting behaviour of lead and bismuth nano-particles in ...
Indian Academy of Sciences (India)
Melting behaviour of nanocrystalline interfaces, created by embedding lead and bismuth nanoparticles in quasicrystalline matrices, was studied. Sharply faceted and coherent interfaces can be related to sharper melting transitions, while irregularly shaped and incoherent interfaces can be directly correlated with lowering of ...
Charge and transition densities of samarium isotopes in the interacting Boson model
International Nuclear Information System (INIS)
Moinester, M.A.; Alster, J.; Dieperink, A.E.L.
1982-01-01
The interacting boson approximation (IBA) model has been used to interpret the ground-state charge distributions and lowest 2 + transition charge densities of the even samarium isotopes for A = 144-154. Phenomenological boson transition densities associated with the nucleons comprising the s-and d-bosons of the IBA were determined via a least squares fit analysis of charge and transition densities in the Sm isotopes. The application of these boson trasition densities to higher excited 0 + and 2 + states of Sm, and to 0 + and 2 + transitions in neighboring nuclei, such as Nd and Gd, is described. IBA predictions for the transition densities of the three lowest 2 + levels of 154 Gd are given and compared to theoretical transition densities based on Hartree-Fock calculations. The deduced quadrupole boson transition densities are in fair agreement with densities derived previously from 150 Nd data. It is also shown how certain moments of the best fit boson transition densities can simply and sucessfully describe rms radii, isomer shifts, B(E2) strengths, and transition radii for the Sm isotopes. (orig.)
Workforce Transition Model for DOE-AL non-nuclear reconfiguration
Energy Technology Data Exchange (ETDEWEB)
Stahlman, E.J.; Lewis, R.E.
1993-10-01
The Pacific Northwest Laboratory (PNL) was tasked by the US Department of Energy Albuquerque Field Office (DOE-AL) to develop a workforce assessment and transition planning tool to support integrated decision making at a single DOE installation. The planning tool permits coordinated, integrated workforce planning to manage growth, decline, or transition within a DOE installation. The tool enhances the links and provides commonality between strategic, programmatic, and operations planners and human resources. Successful development and subsequent complex-wide implementation of the model will also facilitate planning at the national level by enforcing a consistent format on data that are now collected by installations in corporate-specific formats that are not amenable to national-level analyses. The workforce assessment and transition planning tool consists of two components: the Workforce Transition Model and the Workforce Budget Constraint Model. The Workforce Transition Model, the preponderant of the two, assists decision makers to identify and evaluates alternatives for transitioning the current workforce to meet the skills required to support projected workforce requirements. The Workforce Budget Constraint Model helps estimate the number of personnel that will be affected given a workforce budget increase or decrease and assists in identifying how the corresponding hiring or layoffs should be distributed across the common occupational classification system (COCS) occupations. The conceptual models and the computer implementation are described.
Montagna, Chiara; Perugini, Diego; De Campos, Christina; Longo, Antonella; Dingwell, Donald Bruce; Papale, Paolo
2015-04-01
Arrival of magma from depth into shallow reservoirs and associated mixing processes have been documented as possible triggers of explosive eruptions. Quantifying the timing from beginning of mixing to eruption is of fundamental importance in volcanology in order to put constraints about the possible onset of a new eruption. Here we integrate numerical simulations and high-temperature experiment performed with natural melts with the aim to attempt identifying the mixing-to-eruption timescales. We performed two-dimensional numerical simulations of the arrival of gas-rich magmas into shallow reservoirs. We solve the fluid dynamics for the two interacting magmas evaluating the space-time evolution of the physical properties of the mixture. Convection and mingling develop quickly into the chamber and feeding conduit/dyke. Over time scales of hours, the magmas in the reservoir appear to have mingled throughout, and convective patterns become harder to identify. High-temperature magma mixing experiments have been performed using a centrifuge and using basaltic and phonolitic melts from Campi Flegrei (Italy) as initial end-members. Concentration Variance Decay (CVD), an inevitable consequence of magma mixing, is exponential with time. The rate of CVD is a powerful new geochronometer for the time from mixing to eruption/quenching. The mingling-to-eruption time of three explosive volcanic eruptions from Campi Flegrei (Italy) yield durations on the order of tens of minutes. These results are in perfect agreement with the numerical simulations that suggest a maximum mixing time of a few hours to obtain a hybrid mixture. We show that integration of numerical simulation and high-temperature experiments can provide unprecedented results about mixing processes in volcanic systems. The combined application of numerical simulations and CVD geochronometer to the eruptive products of active volcanoes could be decisive for the preparation of hazard mitigation during volcanic unrest.
Triantou, Marianna I; Tarantili, Petroula A; Andreopoulos, Andreas G
2015-05-01
In the present research, blending of polymers used in electrical and electronic equipment, i.e. acrylonitrile-butadiene-styrene terpolymer, polycarbonate and polypropylene, was performed in a twin-screw extruder, in order to explore the effect process parameters on the mixture properties, in an attempt to determine some characteristics of a fast and economical procedure for waste management. The addition of polycarbonate in acrylonitrile-butadiene-styrene terpolymer seemed to increase its thermal stability. Also, the addition of polypropylene in acrylonitrile-butadiene-styrene terpolymer facilitates its melt processing, whereas the addition of acrylonitrile-butadiene-styrene terpolymer in polypropylene improves its mechanical performance. Moreover, the upgrading of the above blends by incorporating 2 phr organically modified montmorillonite was investigated. The prepared nanocomposites exhibit greater tensile strength, elastic modulus and storage modulus, as well as higher melt viscosity, compared with the unreinforced blends. The incorporation of montmorillonite nanoplatelets in polycarbonate-rich acrylonitrile-butadiene-styrene terpolymer/polycarbonate blends turns the thermal degradation mechanism into a two-stage process. Alternatively to mechanical recycling, the energy recovery from the combustion of acrylonitrile-butadiene-styrene terpolymer/polycarbonate and acrylonitrile-butadiene-styrene terpolymer/polypropylene blends was recorded by measuring the gross calorific value. Comparing the investigated polymers, polypropylene presents the higher gross calorific value, followed by acrylonitrile-butadiene-styrene terpolymer and then polycarbonate. The above study allows a rough comparative evaluation of various methodologies for treating plastics from waste from electrical and electronic equipment. © The Author(s) 2015.
Mechanistic modeling of transition temperature shift of Japanese RPV materials
Energy Technology Data Exchange (ETDEWEB)
Hiranuma, N. [Tokyo Electric Power Co., Tokyo (Japan); Soneda, N.; Dohi, K.; Ishino, S. [Central Research Inst. of Electric Power Industry, Tokyo (Japan); Dohi, N. [Kansai Electric Power Co., Osaka (Japan); Ohata, H. [The Japan Atomic Power Co., Tokyo (Japan)
2004-07-01
A new correlation method to predict neutron irradiation embrittlement of reactor pressure vessel (RPV) materials of Japanese nuclear power plants is developed based on the understandings of the embrittlement mechanisms. A set of rate equations is constructed to describe the microstructural changes in the RPV materials during irradiation. Formation of copper-enriched clusters (CEC) and matrix damage (MD) are considered as the two primary causes of the embrittlement. Not only the effects of chemical compositions, such as copper and nickel, and neutron fluence, but also the effects of irradiation temperature as well as neutron flux are formulated in the rate equations to describe the evolution of CEC and MD. Transition temperature shifts corresponding to the microstructural changes are calculated using the predicted number densities of the CEC and MD. Coefficients of the rate equations are optimized using the Japanese surveillance database with a specific attention to reproduce the embrittlement trend of each material of the Japanese RPVs. The standard deviation of 12.1 C of the current Japanese correlation method, JEAC 4201, is reduced down to 10.6 C in the proposed new correlation method. Possibility of adjusting the uncertainty in the initial transition temperatures is discussed. (orig.)
Role of secondary instability theory and parabolized stability equations in transition modeling
El-Hady, Nabil M.; Dinavahi, Surya P.; Chang, Chau-Lyan; Zang, Thomas A.
1993-01-01
In modeling the laminar-turbulent transition region, the designer depends largely on benchmark data from experiments and/or direct numerical simulations that are usually extremely expensive. An understanding of the evolution of the Reynolds stresses, turbulent kinetic energy, and quantifies in the transport equations like the dissipation and production is essential in the modeling process. The secondary instability theory and the parabolized stability equations method are used to calculate these quantities, which are then compared with corresponding quantities calculated from available direct numerical simulation data for the incompressible boundary-layer flow of laminar-turbulent transition conditions. The potential of the secondary instability theory and the parabolized stability equations approach in predicting these quantities is discussed; results indicate that inexpensive data that are useful for transition modeling in the early stages of the transition region can be provided by these tools.
An Optimal Allocation Model of Public Transit Mode Proportion for the Low-Carbon Transportation
Directory of Open Access Journals (Sweden)
Linjun Lu
2015-01-01
Full Text Available Public transit has been widely recognized as a potential way to develop low-carbon transportation. In this paper, an optimal allocation model of public transit mode proportion (MPMP has been built to achieve the low-carbon public transit. Optimal ratios of passenger traffic for rail, bus, and taxi are derived by running the model using typical data. With different values of traffic demand, construction cost, travel time, and accessibilities, MPMP can generate corresponding optimal ratios, benefiting decision impacts analysis and decision makers. Instead of considering public transit as a united system, it is separated into units in this paper. And Shanghai is used to test model validity and practicality.
Implementation of an inter-agency transition model for youth with spina bifida.
Lindsay, S; Cruickshank, H; McPherson, A C; Maxwell, J
2016-03-01
To address gaps in transfer of care and transition support, a paediatric hospital and adult community health care centre partnered to implement an inter-agency transition model for youth with spina bifida. Our objective was to understand the enablers and challenges experienced in the implementation of the model. Using a descriptive, qualitative design, we conducted semi-structured interviews, in-person or over the phone, with 12 clinicians and nine key informants involved in implementing the spina bifida transition model. We recruited all 21 participants from an urban area of Ontario, Canada. Clinicians and key informants experienced several enablers and challenges in implementing the spina bifida transition model. Enablers included dedicated leadership, advocacy, funding, inter-agency partnerships, cross-appointed staff and gaps in co-ordinated care to connect youth to adult services. Challenges included gaps in the availability of adult specialty services, limited geographical catchment of adult services, limited engagement of front-line staff, gaps in communication and role clarity. Although the transition model has realized some initial successes, there are still many challenges to overcome in transferring youth with spina bifida to adult health care and transitioning to adulthood. © 2015 John Wiley & Sons Ltd.
The Ising model and its applications to a phase transition of biological interest
International Nuclear Information System (INIS)
Cabrera, G.G.; Stein-Barana, A.M.; Zuckermann, M.J.
1984-01-01
It is investigated a gel-liquid crystal phase transition employing a two-state model equivalent to the Spin 1/2 Ising Model with applied magnetic field. The model is studied from the standpoint of the cluster variational method of Kikuchi for cooperative phenomena. (M.W.O.) [pt
The Multi-state Latent Factor Intensity Model for Credit Rating Transitions
Koopman, S.J.; Lucas, A.; Monteiro, A.
2008-01-01
A new empirical reduced-form model for credit rating transitions is introduced. It is a parametric intensity-based duration model with multiple states and driven by exogenous covariates and latent dynamic factors. The model has a generalized semi-Markov structure designed to accommodate many of the
First Order Electroweak Phase Transition from (Non)Conformal Extensions of the Standard Model
DEFF Research Database (Denmark)
Sannino, Francesco; Virkajärvi, Jussi
2015-01-01
We analyse and compare the finite-temperature electroweak phase transition properties of classically (non)conformal extensions of the Standard Model. In the classically conformal scenarios the breaking of the electroweak symmetry is generated radiatively. The models feature new scalars coupled co...... the associated models are testable at the upcoming Large Hadron Collider run two experiments....
Metastable liquid-liquid transition in a molecular model of water.
Palmer, Jeremy C; Martelli, Fausto; Liu, Yang; Car, Roberto; Panagiotopoulos, Athanassios Z; Debenedetti, Pablo G
2014-06-19
Liquid water's isothermal compressibility and isobaric heat capacity, and the magnitude of its thermal expansion coefficient, increase sharply on cooling below the equilibrium freezing point. Many experimental, theoretical and computational studies have sought to understand the molecular origin and implications of this anomalous behaviour. Of the different theoretical scenarios put forward, one posits the existence of a first-order phase transition that involves two forms of liquid water and terminates at a critical point located at deeply supercooled conditions. Some experimental evidence is consistent with this hypothesis, but no definitive proof of a liquid-liquid transition in water has been obtained to date: rapid ice crystallization has so far prevented decisive measurements on deeply supercooled water, although this challenge has been overcome recently. Computer simulations are therefore crucial for exploring water's structure and behaviour in this regime, and have shown that some water models exhibit liquid-liquid transitions and others do not. However, recent work has argued that the liquid-liquid transition has been mistakenly interpreted, and is in fact a liquid-crystal transition in all atomistic models of water. Here we show, by studying the liquid-liquid transition in the ST2 model of water with the use of six advanced sampling methods to compute the free-energy surface, that two metastable liquid phases and a stable crystal phase exist at the same deeply supercooled thermodynamic condition, and that the transition between the two liquids satisfies the thermodynamic criteria of a first-order transition. We follow the rearrangement of water's coordination shell and topological ring structure along a thermodynamically reversible path from the low-density liquid to cubic ice. We also show that the system fluctuates freely between the two liquid phases rather than crystallizing. These findings provide unambiguous evidence for a liquid-liquid transition in
Kostogryz, N. M.; Yakobchuk, T. M.; Berdyugina, S. V.; Milic, I.
2017-05-01
Context. To properly interpret photometric and polarimetric observations of exoplanetary transits, accurate calculations of center-to-limb variations of intensity and linear polarization of the host star are needed. These variations, in turn, depend on the choice of geometry of stellar atmosphere. Aims: We want to understand the dependence of the flux and the polarization curves during a transit on the choice of the applied approximation for the stellar atmosphere: spherical and plane-parallel. We examine whether simpler plane-parallel models of stellar atmospheres are good enough to interpret the flux and the polarization light curves during planetary transits, or whether more complicated spherical models should be used. Methods: Linear polarization during a transit appears because a planet eclipses a stellar disk and thus breaks left-right symmetry. We calculate the flux and the polarization variations during a transit with given center-to-limb variations of intensity and polarization. Results: We calculate the flux and the polarization variations during transit for a sample of 405 extrasolar systems. Most of them show higher transit polarization for the spherical stellar atmosphere. Our calculations reveal a group of exoplanetary systems that demonstrates lower maximum polarization during the transits with spherical model atmospheres of host stars with effective temperatures of Teff = 4400-5400 K and surface gravity of log g = 4.45-4.65 than that obtained with plane-parallel atmospheres. Moreover, we have found two trends of the transit polarization. The first trend is a decrease in the polarization calculated with spherical model atmosphere of host stars with effective temperatures Teff = 3500-5100 K, and the second shows an increase in the polarization for host stars with Teff = 5100-7000 K. These trends can be explained by the relative variation of temperature and pressure dependences in the plane-parallel and spherical model atmospheres. Conclusions: For
Extinction phase transitions in a model of ecological and evolutionary dynamics
Barghathi, Hatem; Tackkett, Skye; Vojta, Thomas
2017-07-01
We study the non-equilibrium phase transition between survival and extinction of spatially extended biological populations using an agent-based model. We especially focus on the effects of global temporal fluctuations of the environmental conditions, i.e., temporal disorder. Using large-scale Monte-Carlo simulations of up to 3 × 107 organisms and 105 generations, we find the extinction transition in time-independent environments to be in the well-known directed percolation universality class. In contrast, temporal disorder leads to a highly unusual extinction transition characterized by logarithmically slow population decay and enormous fluctuations even for large populations. The simulations provide strong evidence for this transition to be of exotic infinite-noise type, as recently predicted by a renormalization group theory. The transition is accompanied by temporal Griffiths phases featuring a power-law dependence of the life time on the population size.
A congested and dwell time dependent transit corridor assignment model
Alonso Oreña, Borja; Muñoz, Juan Carlos; Ibeas Portilla, Ángel; Moura Berodia, José Luis
2016-01-01
This research proposes an equilibrium assignment model for congested public transport corridors in urban areas. In this model, journey times incorporate the effect of bus queuing on travel times and boarding and alighting passengers on dwell times at stops. The model also considers limited bus capacity leading to longer waiting times and more uncomfortable journeys. The proposed model is applied to an example network, and the results are compared with those obtained in a recent study. This is...
Kowitz, A.; Güldemeister, N.; Reimold, W. U.; Schmitt, R. T.; Wünnemann, K.
2013-12-01
A combination of shock recovery experiments and numerical modeling of shock deformation in the low pressure range from 2.5 to 17.5 GPa in dry, porous Seeberger sandstone provides new, significant insights with respect to the heterogeneous nature of shock distribution in such important, upper crustal material, for which to date no pressure-calibrated scheme for shock metamorphism exists. We found that pores are already completely closed at 2.5 GPa shock pressure. Whole quartz grains or parts of them are transformed to diaplectic quartz glass and/or SiO2 melt starting already at 5 GPa, whereas these effects are not observed below shock pressures of 30-35 and ˜45 GPa, respectively, in shock experiments with quartz single crystals. The appearance of diaplectic glass or melt is not restricted to the zone directly below the impacted surface but is related to the occurrence of pores in a much broader zone. The combined amount of these phases increases distinctly with increasing shock pressure from 0.03 vol.% at 5 GPa to ˜80 vol.% at 17.5 GPa. In accordance with a previous shock classification for silica phases in naturally shocked Coconino sandstone from Meteor Crater that was based on varied slopes of the Coconino sandstone Hugoniot curve, our observations allow us to construct a shock pressure classification for porous sandstone consistent with shock stages 1b-4 of the progressive shock metamorphism classification of Kieffer (1971).
Finite temperature spin-dynamics and phase transitions in spin-orbital models
Energy Technology Data Exchange (ETDEWEB)
Chen, C.-C.
2010-04-29
We study finite temperature properties of a generic spin-orbital model relevant to transition metal compounds, having coupled quantum Heisenberg-spin and Ising-orbital degrees of freedom. The model system undergoes a phase transition, consistent with that of a 2D Ising model, to an orbitally ordered state at a temperature set by short-range magnetic order. At low temperatures the orbital degrees of freedom freeze-out and the model maps onto a quantum Heisenberg model. The onset of orbital excitations causes a rapid scrambling of the spin spectral weight away from coherent spin-waves, which leads to a sharp increase in uniform magnetic susceptibility just below the phase transition, reminiscent of the observed behavior in the Fe-pnictide materials.
Volume variation of Gruneisen parameters of fcc transition metals
Indian Academy of Sciences (India)
Unknown
ultrasonic measurements and melting of solids (Mulargia and Boschi 1978 .... Several studies in the past based on model pseudo- potential suggest ... Volume variation of fcc transition metals. 65. The present value for Cu is in good agreement with the experimental values. Also, the presently obtained value agrees well with ...
The Wigner solution and QCD phase transitions in a modified PNJL model
Energy Technology Data Exchange (ETDEWEB)
Cui, Zhu-fang [Nanjing University, Department of Physics, Key Laboratory of Modern Acoustics, MOE, Institute of Acoustics, Nanjing (China); State Key Laboratory of Theoretical Physics, Institute of Theoretical Physics, CAS, Beijing (China); Shi, Chao [Nanjing University, Department of Physics, Nanjing (China); State Key Laboratory of Theoretical Physics, Institute of Theoretical Physics, CAS, Beijing (China); Sun, Wei-min; Zong, Hong-shi [Nanjing University, Department of Physics, Nanjing (China); Joint Center for Particle, Nuclear Physics and Cosmology, Nanjing (China); State Key Laboratory of Theoretical Physics, Institute of Theoretical Physics, CAS, Beijing (China); Wang, Yong-long [Nanjing University, Department of Physics, Key Laboratory of Modern Acoustics, MOE, Institute of Acoustics, Nanjing (China); Linyi University, Department of Physics, School of Science, Linyi (China); Massachusetts Institute of Technology, Center for Theoretical Physics, Cambridge, MA (United States)
2014-02-15
By employing some modification to the widely used two-flavor Polyakov-loop extended Nambu-Jona-Lasinio (PNJL) model, we discuss the Wigner solution of the quark gap equation at finite temperature and zero quark chemical potential beyond the chiral limit, and then we try to explore its influence on the chiral and deconfinement phase transitions of QCD at finite temperature and zero chemical potential. The discovery of the coexistence of the Nambu and the Wigner solutions of the quark gap equation with nonzero current quark mass at zero temperature and zero chemical potential, as well as their evolutions with temperature, is very interesting for the studies of the phase transitions of QCD. According to our results, the chiral phase transition might be of first order (while the deconfinement phase transition is still a crossover, as in the normal PNJL model), and the corresponding phase transition temperature is lower than that of the deconfinement phase transition, instead of coinciding with each other, which are not the same as the conclusions obtained from the normal PNJL model. In addition, we also discuss the sensibility of our final results on the choice of model parameters. (orig.)
Evaluating transit operator efficiency: An enhanced DEA model with constrained fuzzy-AHP cones
Xin Li; Yue Liu; Yaojun Wang; Zhigang Gao
2016-01-01
This study addresses efforts to comb the Analytic Hierarchy Process (AHP) with Data Envelopment Analysis (DEA) to deliver a robust enhanced DEA model for transit operator efficiency assessment. The proposed model is designed to better capture inherent preferences information over input and output indicators by adding constraint cones to the conventional DEA model. A revised fuzzy-AHP model is employed to generate cones, where the proposed model features the integration of the fuzzy logic with...
Shape evolution of a melting nonspherical particle.
Kintea, Daniel M; Hauk, Tobias; Roisman, Ilia V; Tropea, Cameron
2015-09-01
In this study melting of irregular ice crystals was observed in an acoustic levitator. The evolution of the particle shape is captured using a high-speed video system. Several typical phenomena have been discovered: change of the particle shape, appearance of a capillary flow of the melted liquid on the particle surface leading to liquid collection at the particle midsection (where the interface curvature is smallest), and appearance of sharp cusps at the particle tips. No such phenomena can be observed during melting of spherical particles. An approximate theoretical model is developed which accounts for the main physical phenomena associated with melting of an irregular particle. The agreement between the theoretical predictions for the melting time, for the evolution of the particle shape, and the corresponding experimental data is rather good.
Energy Technology Data Exchange (ETDEWEB)
Nandi, Taraj; Brasseur, James; Vijayakumar, Ganesh
2016-01-04
This study is aimed at gaining insight into the nonsteady transitional boundary layer dynamics of wind turbine blades and the predictive capabilities of URANS based transition and turbulence models for similar physics through the analysis of a controlled flow with similar nonsteady parameters.
Numazawa, Satoshi; Smith, Roger
2011-10-01
Classical harmonic transition state theory is considered and applied in discrete lattice cells with hierarchical transition levels. The scheme is then used to determine transitions that can be applied in a lattice-based kinetic Monte Carlo (KMC) atomistic simulation model. The model results in an effective reduction of KMC simulation steps by utilizing a classification scheme of transition levels for thermally activated atomistic diffusion processes. Thermally activated atomistic movements are considered as local transition events constrained in potential energy wells over certain local time periods. These processes are represented by Markov chains of multidimensional Boolean valued functions in three-dimensional lattice space. The events inhibited by the barriers under a certain level are regarded as thermal fluctuations of the canonical ensemble and accepted freely. Consequently, the fluctuating system evolution process is implemented as a Markov chain of equivalence class objects. It is shown that the process can be characterized by the acceptance of metastable local transitions. The method is applied to a problem of Au and Ag cluster growth on a rippled surface. The simulation predicts the existence of a morphology-dependent transition time limit from a local metastable to stable state for subsequent cluster growth by accretion. Excellent agreement with observed experimental results is obtained.
Non-robust Phase Transitions in the Generalized Clock Model on Trees
Külske, C.; Schriever, P.
2018-01-01
Pemantle and Steif provided a sharp threshold for the existence of a robust phase transition (RPT) for the continuous rotator model and the Potts model in terms of the branching number and the second eigenvalue of the transfer matrix whose kernel describes the nearest neighbor interaction along the edges of the tree. Here a RPT is said to occur if an arbitrarily weak coupling with symmetry-breaking boundary conditions suffices to induce symmetry breaking in the bulk. They further showed that for the Potts model RPT occurs at a different threshold than PT (phase transition in the sense of multiple Gibbs measures), and conjectured that RPT and PT should occur at the same threshold in the continuous rotator model. We consider the class of four- and five-state rotation-invariant spin models with reflection symmetry on general trees which contains the Potts model and the clock model with scalarproduct-interaction as limiting cases. The clock model can be viewed as a particular discretization which is obtained from the classical rotator model with state space S^1. We analyze the transition between PT=RPT and PT≠ RPT, in terms of the eigenvalues of the transfer matrix of the model at the critical threshold value for the existence of RPT. The transition between the two regimes depends sensitively on the third largest eigenvalue.